4-[[2-(3,5-dimethylpiperidin-1-yl)-4-methyl-quinolin-6-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[2-(3,5-dimethylpiperidin-1-yl)-4-methyl-quinolin-6-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[2-(3,5-dimethyl-1-piperidyl)-4-methyl-6-quinolyl]amino]-4-oxo-butanoic acid CAS Name: 4-[[2-(3,5-dimethyl-1-piperidinyl)-4-methyl-6-quinolinyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[2-(3,5-dimethylpiperidin-1-yl)-4-methylquinolin-6-yl]amino]-4-oxobutanoic acid Traditional Name: 4-[[2-(3,5-dimethylpiperidino)-4-methyl-6-quinolyl]amino]-4-keto-butyric acid Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C2=NC3=C(C=C(C=C3)NC(=O)CCC(=O)O)C(=C2)C)C

Isomeric SMILES

CC1CC(CN(C1)C2=NC3=C(C=C(C=C3)NC(=O)CCC(=O)O)C(=C2)C)C

InChI

InChI=1S/C21H27N3O3/c1-13-8-14(2)12-24(11-13)19-9-15(3)17-10-16(4-5-18(17)23-19)22-20(25)6-7-21(26)27/h4-5,9-10,13-14H,6-8,11-12H2,1-3H3,(H,22,25)(H,26,27)