1-[(6,8-dimethyl-4-oxidanylidene-1H-quinolin-2-yl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(6,8-dimethyl-4-oxidanylidene-1H-quinolin-2-yl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(6,8-dimethyl-4-oxo-1H-quinolin-2-yl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(6,8-dimethyl-4-oxo-1H-quinolin-2-yl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(6,8-dimethyl-4-oxo-1H-quinolin-2-yl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[(4-keto-6,8-dimethyl-1H-quinolin-2-yl)methyl]isonipecotic acid Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=O)C=C(N2)CN3CCC(CC3)C(=O)O)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=O)C=C(N2)CN3CCC(CC3)C(=O)O)C

InChI

InChI=1S/C18H22N2O3/c1-11-7-12(2)17-15(8-11)16(21)9-14(19-17)10-20-5-3-13(4-6-20)18(22)23/h7-9,13H,3-6,10H2,1-2H3,(H,19,21)(H,22,23)