2-[[1-(3-methoxyphenyl)carbonyl-3-oxidanylidene-2-propan-2-yl-2,4-dihydroquinoxalin-6-yl]carbonylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[1-(3-methoxyphenyl)carbonyl-3-oxidanylidene-2-propan-2-yl-2,4-dihydroquinoxalin-6-yl]carbonylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[2-isopropyl-1-(3-methoxybenzoyl)-3-oxo-2,4-dihydroquinoxaline-6-carbonyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[[1-[(3-methoxyphenyl)-oxomethyl]-3-oxo-2-propan-2-yl-2,4-dihydroquinoxalin-6-yl]-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[1-(3-methoxybenzoyl)-3-oxo-2-propan-2-yl-2,4-dihydroquinoxaline-6-carbonyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[(2-isopropyl-3-keto-1-m-anisoyl-2,4-dihydroquinoxaline-6-carbonyl)amino]-3-phenyl-propionic acid Formula: C29H29N3O6 MolecularWeight: 515.55706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)NC2=C(N1C(=O)C3=CC(=CC=C3)OC)C=CC(=C2)C(=O)NC(CC4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC(C)C1C(=O)NC2=C(N1C(=O)C3=CC(=CC=C3)OC)C=CC(=C2)C(=O)NC(CC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C29H29N3O6/c1-17(2)25-27(34)30-22-16-19(26(33)31-23(29(36)37)14-18-8-5-4-6-9-18)12-13-24(22)32(25)28(35)20-10-7-11-21(15-20)38-3/h4-13,15-17,23,25H,14H2,1-3H3,(H,30,34)(H,31,33)(H,36,37)