2-[[2-methyl-3-oxidanylidene-1-(3-phenylpropanoyl)-2,4-dihydroquinoxalin-6-yl]carbonylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[2-methyl-3-oxidanylidene-1-(3-phenylpropanoyl)-2,4-dihydroquinoxalin-6-yl]carbonylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[2-methyl-3-oxo-1-(3-phenylpropanoyl)-2,4-dihydroquinoxaline-6-carbonyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[[2-methyl-3-oxo-1-(1-oxo-3-phenylpropyl)-2,4-dihydroquinoxalin-6-yl]-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[2-methyl-3-oxo-1-(3-phenylpropanoyl)-2,4-dihydroquinoxaline-6-carbonyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[(1-hydrocinnamoyl-3-keto-2-methyl-2,4-dihydroquinoxaline-6-carbonyl)amino]-3-phenyl-propionic acid Formula: C28H27N3O5 MolecularWeight: 485.53108

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(N1C(=O)CCC3=CC=CC=C3)C=CC(=C2)C(=O)NC(CC4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC1C(=O)NC2=C(N1C(=O)CCC3=CC=CC=C3)C=CC(=C2)C(=O)NC(CC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C28H27N3O5/c1-18-26(33)29-22-17-21(27(34)30-23(28(35)36)16-20-10-6-3-7-11-20)13-14-24(22)31(18)25(32)15-12-19-8-4-2-5-9-19/h2-11,13-14,17-18,23H,12,15-16H2,1H3,(H,29,33)(H,30,34)(H,35,36)