E82
Summary
| Name: | 3-[3-(aminomethyl)phenyl]-~{N}-[(1~{S})-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide |
| Formula: | C24 H24 N2 O |
| Formal charge: | 0 |
| Formula weight: | 356.46 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 3-[3-(aminomethyl)phenyl]-~{N}-[(1~{S})-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C24H24N2O/c25-16-17-6-3-9-19(14-17)20-10-4-11-21(15-20)24(27)26-23-13-5-8-18-7-1-2-12-22(18)23/h1-4,6-7,9-12,14-15,23H,5,8,13,16,25H2,(H,26,27)/t23-/m0/s1 |
| InChIKey | InChI | 1.03 | ONRUCWPTBOHFGA-QHCPKHFHSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NCc1cccc(c1)c2cccc(c2)C(=O)N[C@H]3CCCc4ccccc34 |
| SMILES | CACTVS | 3.385 | NCc1cccc(c1)c2cccc(c2)C(=O)N[CH]3CCCc4ccccc34 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1ccc2c(c1)CCC[C@@H]2NC(=O)c3cccc(c3)c4cccc(c4)CN |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc2c(c1)CCCC2NC(=O)c3cccc(c3)c4cccc(c4)CN |
