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

Systemtic Name: 2-[[4-oxidanylidene-2-phenyl-1-(2-phenylethanoyl)-3,5-dihydro-2H-1,5-benzodiazepin-7-yl]carbonylamino]propanoic acid Openeye Name: 2-[[4-oxo-2-phenyl-1-(2-phenylacetyl)-3,5-dihydro-2H-1,5-benzodiazepine-7-carbonyl]amino]propanoic acid CAS Name: 2-[[oxo-[4-oxo-1-(1-oxo-2-phenylethyl)-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-7-yl]methyl]amino]propanoic acid IUPAC Name: 2-[[4-oxo-2-phenyl-1-(2-phenylacetyl)-3,5-dihydro-2H-1,5-benzodiazepine-7-carbonyl]amino]propanoic acid Traditional Name: 2-[[4-keto-2-phenyl-1-(2-phenylacetyl)-3,5-dihydro-2H-1,5-benzodiazepine-7-carbonyl]amino]propionic acid Formula: C27H25N3O5 MolecularWeight: 471.5045

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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)CC4=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)CC4=CC=CC=C4

InChI

InChI=1S/C27H25N3O5/c1-17(27(34)35)28-26(33)20-12-13-22-21(15-20)29-24(31)16-23(19-10-6-3-7-11-19)30(22)25(32)14-18-8-4-2-5-9-18/h2-13,15,17,23H,14,16H2,1H3,(H,28,33)(H,29,31)(H,34,35)