N-[3-[2-(diethylaminomethyl)piperidin-1-yl]propyl]-6-oxidanylidene-5H-benzo[b][1,4]benzodiazepine-11-carboxamide

Systemtic Name: N-[3-[2-(diethylaminomethyl)piperidin-1-yl]propyl]-6-oxidanylidene-5H-benzo[b][1,4]benzodiazepine-11-carboxamide Openeye Name: N-[3-[2-(diethylaminomethyl)-1-piperidyl]propyl]-6-oxo-5H-benzo[b][1,4]benzodiazepine-11-carboxamide CAS Name: N-[3-[2-(diethylaminomethyl)-1-piperidinyl]propyl]-6-oxo-5H-benzo[b][1,4]benzodiazepine-11-carboxamide IUPAC Name: N-[3-[2-(diethylaminomethyl)piperidin-1-yl]propyl]-6-oxo-5H-benzo[b][1,4]benzodiazepine-11-carboxamide Traditional Name: N-[3-[2-(diethylaminomethyl)piperidino]propyl]-6-keto-5H-benzo[b][1,4]benzodiazepine-11-carboxamide Formula: C27H37N5O2 MolecularWeight: 463.61498

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1CCCCN1CCCNC(=O)N2C3=CC=CC=C3C(=O)NC4=CC=CC=C42

Isomeric SMILES

CCN(CC)CC1CCCCN1CCCNC(=O)N2C3=CC=CC=C3C(=O)NC4=CC=CC=C42

InChI

InChI=1S/C27H37N5O2/c1-3-30(4-2)20-21-12-9-10-18-31(21)19-11-17-28-27(34)32-24-15-7-5-13-22(24)26(33)29-23-14-6-8-16-25(23)32/h5-8,13-16,21H,3-4,9-12,17-20H2,1-2H3,(H,28,34)(H,29,33)