N-(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)-2-(2-methylpropyl)-3-oxidanyl-nonanamide

Systemtic Name: N-(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)-2-(2-methylpropyl)-3-oxidanyl-nonanamide Openeye Name: 3-hydroxy-2-isobutyl-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)nonanamide CAS Name: 3-hydroxy-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-2-(2-methylpropyl)nonanamide IUPAC Name: 3-hydroxy-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-2-(2-methylpropyl)nonanamide Traditional Name: 3-hydroxy-2-isobutyl-N-(2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)pelargonamide Formula: C29H39N3O3 MolecularWeight: 477.63826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(CC(C)C)C(=O)NC1C(=O)N(C2=CC=CC=C2C(=N1)C3=CC=CC=C3)C)O

Isomeric SMILES

CCCCCCC(C(CC(C)C)C(=O)NC1C(=O)N(C2=CC=CC=C2C(=N1)C3=CC=CC=C3)C)O

InChI

InChI=1S/C29H39N3O3/c1-5-6-7-11-18-25(33)23(19-20(2)3)28(34)31-27-29(35)32(4)24-17-13-12-16-22(24)26(30-27)21-14-9-8-10-15-21/h8-10,12-17,20,23,25,27,33H,5-7,11,18-19H2,1-4H3,(H,31,34)