(3R)-5-[(2-methylquinolin-6-yl)amino]-5-oxidanylidene-3-phenyl-pentanoic acid

Systemtic Name: (3R)-5-[(2-methylquinolin-6-yl)amino]-5-oxidanylidene-3-phenyl-pentanoic acid Openeye Name: (3R)-5-[(2-methyl-6-quinolyl)amino]-5-oxo-3-phenyl-pentanoic acid CAS Name: (3R)-5-[(2-methyl-6-quinolinyl)amino]-5-oxo-3-phenylpentanoic acid IUPAC Name: (3R)-5-[(2-methylquinolin-6-yl)amino]-5-oxo-3-phenylpentanoic acid Traditional Name: (3R)-5-keto-5-[(2-methyl-6-quinolyl)amino]-3-phenyl-valeric acid Formula: C21H20N2O3 MolecularWeight: 348.3951

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C=C(C=C2)NC(=O)CC(CC(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC1=NC2=C(C=C1)C=C(C=C2)NC(=O)C[C@H](CC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C21H20N2O3/c1-14-7-8-16-11-18(9-10-19(16)22-14)23-20(24)12-17(13-21(25)26)15-5-3-2-4-6-15/h2-11,17H,12-13H2,1H3,(H,23,24)(H,25,26)/t17-/m1/s1