1-chloranyl-11-[2-(1-methylpiperidin-4-yl)ethanoyl]-5H-benzo[b][1,4]benzodiazepin-6-one hydrochloride

Systemtic Name: 1-chloranyl-11-[2-(1-methylpiperidin-4-yl)ethanoyl]-5H-benzo[b][1,4]benzodiazepin-6-one hydrochloride Openeye Name: 1-chloro-11-[2-(1-methyl-4-piperidyl)acetyl]-5H-benzo[b][1,4]benzodiazepin-6-one hydrochloride CAS Name: 1-chloro-11-[2-(1-methyl-4-piperidinyl)-1-oxoethyl]-5H-benzo[b][1,4]benzodiazepin-6-one hydrochloride IUPAC Name: 1-chloro-11-[2-(1-methylpiperidin-4-yl)acetyl]-5H-benzo[b][1,4]benzodiazepin-6-one hydrochloride Traditional Name: 1-chloro-11-[2-(1-methyl-4-piperidyl)acetyl]-5H-benzo[b][1,4]benzodiazepin-6-one hydrochloride Formula: C21H23Cl2N3O2 MolecularWeight: 420.33222

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)CC(=O)N2C3=CC=CC=C3C(=O)NC4=C2C(=CC=C4)Cl.Cl

Isomeric SMILES

CN1CCC(CC1)CC(=O)N2C3=CC=CC=C3C(=O)NC4=C2C(=CC=C4)Cl.Cl

InChI

InChI=1S/C21H22ClN3O2.ClH/c1-24-11-9-14(10-12-24)13-19(26)25-18-8-3-2-5-15(18)21(27)23-17-7-4-6-16(22)20(17)25;/h2-8,14H,9-13H2,1H3,(H,23,27);1H