5-hexanoyl-6-phenyl-9-(2-phenylmethoxyphenyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one

Systemtic Name: 5-hexanoyl-6-phenyl-9-(2-phenylmethoxyphenyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one Openeye Name: 9-(2-benzyloxyphenyl)-5-hexanoyl-6-phenyl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one CAS Name: 5-(1-oxohexyl)-6-phenyl-9-(2-phenylmethoxyphenyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one IUPAC Name: 5-hexanoyl-6-phenyl-9-(2-phenylmethoxyphenyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one Traditional Name: 9-(2-benzoxyphenyl)-5-caproyl-6-phenyl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one Formula: C38H38N2O3 MolecularWeight: 570.71992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N1C(C2=C(CC(CC2=O)C3=CC=CC=C3OCC4=CC=CC=C4)NC5=CC=CC=C51)C6=CC=CC=C6

Isomeric SMILES

CCCCCC(=O)N1C(C2=C(CC(CC2=O)C3=CC=CC=C3OCC4=CC=CC=C4)NC5=CC=CC=C51)C6=CC=CC=C6

InChI

InChI=1S/C38H38N2O3/c1-2-3-6-23-36(42)40-33-21-13-12-20-31(33)39-32-24-29(25-34(41)37(32)38(40)28-17-9-5-10-18-28)30-19-11-14-22-35(30)43-26-27-15-7-4-8-16-27/h4-5,7-22,29,38-39H,2-3,6,23-26H2,1H3