6-(4-chlorophenyl)-5-ethanoyl-9-(furan-2-yl)-6a,8,9,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one

Systemtic Name: 6-(4-chlorophenyl)-5-ethanoyl-9-(furan-2-yl)-6a,8,9,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one Openeye Name: 5-acetyl-6-(4-chlorophenyl)-9-(2-furyl)-6a,8,9,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one CAS Name: 5-acetyl-6-(4-chlorophenyl)-9-(2-furanyl)-6a,8,9,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one IUPAC Name: 5-acetyl-6-(4-chlorophenyl)-9-(furan-2-yl)-6a,8,9,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one Traditional Name: 5-acetyl-6-(4-chlorophenyl)-9-(2-furyl)-6a,8,9,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one Formula: C25H21ClN2O3 MolecularWeight: 432.89884

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(C2C(=O)CC(C=C2NC3=CC=CC=C31)C4=CC=CO4)C5=CC=C(C=C5)Cl

Isomeric SMILES

CC(=O)N1C(C2C(=O)CC(C=C2NC3=CC=CC=C31)C4=CC=CO4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H21ClN2O3/c1-15(29)28-21-6-3-2-5-19(21)27-20-13-17(23-7-4-12-31-23)14-22(30)24(20)25(28)16-8-10-18(26)11-9-16/h2-13,17,24-25,27H,14H2,1H3