3-chloranyl-6-[4-(cyclopropylmethyl)piperazin-1-yl]-5H-benzo[b][1,4]benzodiazepine

Systemtic Name: 3-chloranyl-6-[4-(cyclopropylmethyl)piperazin-1-yl]-5H-benzo[b][1,4]benzodiazepine Openeye Name: 3-chloro-6-[4-(cyclopropylmethyl)piperazin-1-yl]-5H-benzo[b][1,4]benzodiazepine CAS Name: 3-chloro-6-[4-(cyclopropylmethyl)-1-piperazinyl]-5H-benzo[b][1,4]benzodiazepine IUPAC Name: 3-chloro-6-[4-(cyclopropylmethyl)piperazin-1-yl]-5H-benzo[b][1,4]benzodiazepine Traditional Name: 3-chloro-6-[4-(cyclopropylmethyl)piperazino]-5H-benzo[b][1,4]benzodiazepine Formula: C21H23ClN4 MolecularWeight: 366.88712

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN2CCN(CC2)C3=C4C=CC=CC4=NC5=C(N3)C=C(C=C5)Cl

Isomeric SMILES

C1CC1CN2CCN(CC2)C3=C4C=CC=CC4=NC5=C(N3)C=C(C=C5)Cl

InChI

InChI=1S/C21H23ClN4/c22-16-7-8-19-20(13-16)24-21(17-3-1-2-4-18(17)23-19)26-11-9-25(10-12-26)14-15-5-6-15/h1-4,7-8,13,15,24H,5-6,9-12,14H2