2-[[2-(4-methoxyphenyl)quinolin-4-yl]carbonylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[[2-(4-methoxyphenyl)quinolin-4-yl]carbonylamino]-3-methyl-butanoic acid Openeye Name: 2-[[2-(4-methoxyphenyl)quinoline-4-carbonyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[[2-(4-methoxyphenyl)-4-quinolinyl]-oxomethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-(4-methoxyphenyl)quinoline-4-carbonyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-(4-methoxyphenyl)quinoline-4-carbonyl]amino]-3-methyl-butyric acid Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H22N2O4/c1-13(2)20(22(26)27)24-21(25)17-12-19(14-8-10-15(28-3)11-9-14)23-18-7-5-4-6-16(17)18/h4-13,20H,1-3H3,(H,24,25)(H,26,27)