N-[3-[4-[2-(8-chloranyl-6-oxidanylidene-5H-benzo[b][1,4]benzodiazepin-11-yl)-2-oxidanylidene-ethyl]phenyl]propyl]-N-ethyl-2,2-dimethyl-pentanamide

Systemtic Name: N-[3-[4-[2-(8-chloranyl-6-oxidanylidene-5H-benzo[b][1,4]benzodiazepin-11-yl)-2-oxidanylidene-ethyl]phenyl]propyl]-N-ethyl-2,2-dimethyl-pentanamide Openeye Name: N-[3-[4-[2-(8-chloro-6-oxo-5H-benzo[b][1,4]benzodiazepin-11-yl)-2-oxo-ethyl]phenyl]propyl]-N-ethyl-2,2-dimethyl-pentanamide CAS Name: N-[3-[4-[2-(8-chloro-6-oxo-5H-benzo[b][1,4]benzodiazepin-11-yl)-2-oxoethyl]phenyl]propyl]-N-ethyl-2,2-dimethylpentanamide IUPAC Name: N-[3-[4-[2-(8-chloro-6-oxo-5H-benzo[b][1,4]benzodiazepin-11-yl)-2-oxoethyl]phenyl]propyl]-N-ethyl-2,2-dimethylpentanamide Traditional Name: N-[3-[4-[2-(8-chloro-6-keto-5H-benzo[b][1,4]benzodiazepin-11-yl)-2-keto-ethyl]phenyl]propyl]-N-ethyl-2,2-dimethyl-valeramide Formula: C33H38ClN3O3 MolecularWeight: 560.12612

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C)C(=O)N(CC)CCCC1=CC=C(C=C1)CC(=O)N2C3=C(C=C(C=C3)Cl)C(=O)NC4=CC=CC=C42

Isomeric SMILES

CCCC(C)(C)C(=O)N(CC)CCCC1=CC=C(C=C1)CC(=O)N2C3=C(C=C(C=C3)Cl)C(=O)NC4=CC=CC=C42

InChI

InChI=1S/C33H38ClN3O3/c1-5-19-33(3,4)32(40)36(6-2)20-9-10-23-13-15-24(16-14-23)21-30(38)37-28-18-17-25(34)22-26(28)31(39)35-27-11-7-8-12-29(27)37/h7-8,11-18,22H,5-6,9-10,19-21H2,1-4H3,(H,35,39)