1-[2-(4-chloranylphenoxy)ethanoyl]-2-(4-methylphenyl)-7-piperazin-1-ylcarbonyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one

Systemtic Name: 1-[2-(4-chloranylphenoxy)ethanoyl]-2-(4-methylphenyl)-7-piperazin-1-ylcarbonyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Openeye Name: 1-[2-(4-chlorophenoxy)acetyl]-7-(piperazine-1-carbonyl)-2-(p-tolyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one CAS Name: 1-[2-(4-chlorophenoxy)-1-oxoethyl]-2-(4-methylphenyl)-7-[oxo(1-piperazinyl)methyl]-3,5-dihydro-2H-1,5-benzodiazepin-4-one IUPAC Name: 1-[2-(4-chlorophenoxy)acetyl]-2-(4-methylphenyl)-7-(piperazine-1-carbonyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Traditional Name: 1-[2-(4-chlorophenoxy)acetyl]-7-(piperazine-1-carbonyl)-2-(p-tolyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Formula: C29H29ClN4O4 MolecularWeight: 533.01796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC(=O)NC3=C(N2C(=O)COC4=CC=C(C=C4)Cl)C=CC(=C3)C(=O)N5CCNCC5

Isomeric SMILES

CC1=CC=C(C=C1)C2CC(=O)NC3=C(N2C(=O)COC4=CC=C(C=C4)Cl)C=CC(=C3)C(=O)N5CCNCC5

InChI

InChI=1S/C29H29ClN4O4/c1-19-2-4-20(5-3-19)26-17-27(35)32-24-16-21(29(37)33-14-12-31-13-15-33)6-11-25(24)34(26)28(36)18-38-23-9-7-22(30)8-10-23/h2-11,16,26,31H,12-15,17-18H2,1H3,(H,32,35)