AA7
Summary
| Name: | N,N'-DI-1,2,3,4-TETRAHYDROACRIDIN-9-YLHEPTANE-1,7-DIAMINE |
| Formula: | C33 H40 N4 |
| Formal charge: | 0 |
| Formula weight: | 492.698 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | N,N'-di-1,2,3,4-tetrahydroacridin-9-ylheptane-1,7-diamine |
| OpenEye OEToolkits | 1.5.0 | N,N'-bis(1,2,3,4-tetrahydroacridin-9-yl)heptane-1,7-diamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | n2c1c(cccc1)c(c3c2CCCC3)NCCCCCCCNc4c6c(nc5c4CCCC5)cccc6 |
| SMILES_CANONICAL | CACTVS | 3.341 | C(CCCNc1c2CCCCc2nc3ccccc13)CCCNc4c5CCCCc5nc6ccccc46 |
| SMILES | CACTVS | 3.341 | C(CCCNc1c2CCCCc2nc3ccccc13)CCCNc4c5CCCCc5nc6ccccc46 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc2c(c1)c(c3c(n2)CCCC3)NCCCCCCCNc4c5ccccc5nc6c4CCCC6 |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc2c(c1)c(c3c(n2)CCCC3)NCCCCCCCNc4c5ccccc5nc6c4CCCC6 |
| InChI | InChI | 1.03 | InChI=1S/C33H40N4/c1(2-12-22-34-32-24-14-4-8-18-28(24)36-29-19-9-5-15-25(29)32)3-13-23-35-33-26-16-6-10-20-30(26)37-31-21-11-7-17-27(31)33/h4,6,8,10,14,16,18,20H,1-3,5,7,9,11-13,15,17,19,21-23H2,(H,34,36)(H,35,37) |
| InChIKey | InChI | 1.03 | ITZOKHKOFJOBFS-UHFFFAOYSA-N |
