8-chloranyl-11-[3-(2-methylpiperidin-1-yl)propanoyl]-5H-benzo[b][1,4]benzodiazepin-6-one

Systemtic Name: 8-chloranyl-11-[3-(2-methylpiperidin-1-yl)propanoyl]-5H-benzo[b][1,4]benzodiazepin-6-one Openeye Name: 8-chloro-11-[3-(2-methyl-1-piperidyl)propanoyl]-5H-benzo[b][1,4]benzodiazepin-6-one CAS Name: 8-chloro-11-[3-(2-methyl-1-piperidinyl)-1-oxopropyl]-5H-benzo[b][1,4]benzodiazepin-6-one IUPAC Name: 8-chloro-11-[3-(2-methylpiperidin-1-yl)propanoyl]-5H-benzo[b][1,4]benzodiazepin-6-one Traditional Name: 8-chloro-11-[3-(2-methylpiperidino)propanoyl]-5H-benzo[b][1,4]benzodiazepin-6-one Formula: C22H24ClN3O2 MolecularWeight: 397.89786

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CCC(=O)N2C3=C(C=C(C=C3)Cl)C(=O)NC4=CC=CC=C42

Isomeric SMILES

CC1CCCCN1CCC(=O)N2C3=C(C=C(C=C3)Cl)C(=O)NC4=CC=CC=C42

InChI

InChI=1S/C22H24ClN3O2/c1-15-6-4-5-12-25(15)13-11-21(27)26-19-10-9-16(23)14-17(19)22(28)24-18-7-2-3-8-20(18)26/h2-3,7-10,14-15H,4-6,11-13H2,1H3,(H,24,28)