DZP
Summary
| Name: | 7-CHLORO-1-METHYL-5-PHENYL-1,3-DIHYDRO-2H-1,4-BENZODIAZEPIN-2-ONE |
| Formula: | C16 H13 Cl N2 O |
| Formal charge: | 0 |
| Formula weight: | 284.74 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 7-chloro-1-methyl-5-phenyl-1,3-dihydro-2H-1,4-benzodiazepin-2-one |
| OpenEye OEToolkits | 1.5.0 | 7-chloro-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | Clc3cc1c(N(C(=O)CN=C1c2ccccc2)C)cc3 |
| SMILES_CANONICAL | CACTVS | 3.341 | CN1C(=O)CN=C(c2ccccc2)c3cc(Cl)ccc13 |
| SMILES | CACTVS | 3.341 | CN1C(=O)CN=C(c2ccccc2)c3cc(Cl)ccc13 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CN1c2ccc(cc2C(=NCC1=O)c3ccccc3)Cl |
| SMILES | OpenEye OEToolkits | 1.5.0 | CN1c2ccc(cc2C(=NCC1=O)c3ccccc3)Cl |
| InChI | InChI | 1.03 | InChI=1S/C16H13ClN2O/c1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11/h2-9H,10H2,1H3 |
| InChIKey | InChI | 1.03 | AAOVKJBEBIDNHE-UHFFFAOYSA-N |
