1-(3,5-dimethylpiperidin-1-yl)isoquinoline-3-carboxylic acid

Systemtic Name: 1-(3,5-dimethylpiperidin-1-yl)isoquinoline-3-carboxylic acid Openeye Name: 1-(3,5-dimethyl-1-piperidyl)isoquinoline-3-carboxylic acid CAS Name: 1-(3,5-dimethyl-1-piperidinyl)-3-isoquinolinecarboxylic acid IUPAC Name: 1-(3,5-dimethylpiperidin-1-yl)isoquinoline-3-carboxylic acid Traditional Name: 1-(3,5-dimethylpiperidino)isoquinoline-3-carboxylic acid Formula: C17H20N2O2 MolecularWeight: 284.3529

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C2=NC(=CC3=CC=CC=C32)C(=O)O)C

Isomeric SMILES

CC1CC(CN(C1)C2=NC(=CC3=CC=CC=C32)C(=O)O)C

InChI

InChI=1S/C17H20N2O2/c1-11-7-12(2)10-19(9-11)16-14-6-4-3-5-13(14)8-15(18-16)17(20)21/h3-6,8,11-12H,7,9-10H2,1-2H3,(H,20,21)