H30
Summary
| Name: | 5'-methoxy-6'-(1-methyl-2,3,4,7-tetrahydroazepin-5-yl)spiro[cyclobutane-1,3'-indole]-2'-amine |
| Formula: | C19 H25 N3 O |
| Formal charge: | 0 |
| Formula weight: | 311.421 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 5'-methoxy-6'-(1-methyl-2,3,4,7-tetrahydroazepin-5-yl)spiro[cyclobutane-1,3'-indole]-2'-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C19H25N3O/c1-22-9-3-5-13(6-10-22)14-11-16-15(12-17(14)23-2)19(7-4-8-19)18(20)21-16/h6,11-12H,3-5,7-10H2,1-2H3,(H2,20,21) |
| InChIKey | InChI | 1.03 | VMVRYCYPSDCNEH-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1cc2c(cc1C3=CCN(C)CCC3)N=C(N)C24CCC4 |
| SMILES | CACTVS | 3.385 | COc1cc2c(cc1C3=CCN(C)CCC3)N=C(N)C24CCC4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CN1CCCC(=CC1)c2cc3c(cc2OC)C4(CCC4)C(=N3)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | CN1CCCC(=CC1)c2cc3c(cc2OC)C4(CCC4)C(=N3)N |
