2-[[4-oxidanylidene-1-(2-phenoxypropanoyl)-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-7-yl]carbonylamino]propanoic acid

Systemtic Name: 2-[[4-oxidanylidene-1-(2-phenoxypropanoyl)-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-7-yl]carbonylamino]propanoic acid Openeye Name: 2-[[4-oxo-1-(2-phenoxypropanoyl)-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepine-7-carbonyl]amino]propanoic acid CAS Name: 2-[[oxo-[4-oxo-1-(1-oxo-2-phenoxypropyl)-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-7-yl]methyl]amino]propanoic acid IUPAC Name: 2-[[4-oxo-1-(2-phenoxypropanoyl)-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepine-7-carbonyl]amino]propanoic acid Traditional Name: 2-[[4-keto-1-(2-phenoxypropanoyl)-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepine-7-carbonyl]amino]propionic acid Formula: C28H27N3O6 MolecularWeight: 501.53048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)C1=CC2=C(C=C1)N(C(CC(=O)N2)C3=CC=CC=C3)C(=O)C(C)OC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)O)NC(=O)C1=CC2=C(C=C1)N(C(CC(=O)N2)C3=CC=CC=C3)C(=O)C(C)OC4=CC=CC=C4

InChI

InChI=1S/C28H27N3O6/c1-17(28(35)36)29-26(33)20-13-14-23-22(15-20)30-25(32)16-24(19-9-5-3-6-10-19)31(23)27(34)18(2)37-21-11-7-4-8-12-21/h3-15,17-18,24H,16H2,1-2H3,(H,29,33)(H,30,32)(H,35,36)