1-chloranyl-11-[3-(2-piperidin-1-ylethyl)piperidin-1-yl]carbonyl-5H-benzo[b][1,4]benzodiazepin-6-one

Systemtic Name: 1-chloranyl-11-[3-(2-piperidin-1-ylethyl)piperidin-1-yl]carbonyl-5H-benzo[b][1,4]benzodiazepin-6-one Openeye Name: 1-chloro-11-[3-[2-(1-piperidyl)ethyl]piperidine-1-carbonyl]-5H-benzo[b][1,4]benzodiazepin-6-one CAS Name: 1-chloro-11-[oxo-[3-[2-(1-piperidinyl)ethyl]-1-piperidinyl]methyl]-5H-benzo[b][1,4]benzodiazepin-6-one IUPAC Name: 1-chloro-11-[3-(2-piperidin-1-ylethyl)piperidine-1-carbonyl]-5H-benzo[b][1,4]benzodiazepin-6-one Traditional Name: 1-chloro-11-[3-(2-piperidinoethyl)piperidine-1-carbonyl]-5H-benzo[b][1,4]benzodiazepin-6-one Formula: C26H31ClN4O2 MolecularWeight: 467.00294

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCC2CCCN(C2)C(=O)N3C4=CC=CC=C4C(=O)NC5=C3C(=CC=C5)Cl

Isomeric SMILES

C1CCN(CC1)CCC2CCCN(C2)C(=O)N3C4=CC=CC=C4C(=O)NC5=C3C(=CC=C5)Cl

InChI

InChI=1S/C26H31ClN4O2/c27-21-10-6-11-22-24(21)31(23-12-3-2-9-20(23)25(32)28-22)26(33)30-16-7-8-19(18-30)13-17-29-14-4-1-5-15-29/h2-3,6,9-12,19H,1,4-5,7-8,13-18H2,(H,28,32)