1-(4-methylpiperidin-1-yl)isoquinoline-3-carboxylic acid

Systemtic Name: 1-(4-methylpiperidin-1-yl)isoquinoline-3-carboxylic acid Openeye Name: 1-(4-methyl-1-piperidyl)isoquinoline-3-carboxylic acid CAS Name: 1-(4-methyl-1-piperidinyl)-3-isoquinolinecarboxylic acid IUPAC Name: 1-(4-methylpiperidin-1-yl)isoquinoline-3-carboxylic acid Traditional Name: 1-(4-methylpiperidino)isoquinoline-3-carboxylic acid Formula: C16H18N2O2 MolecularWeight: 270.32632

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C16H18N2O2/c1-11-6-8-18(9-7-11)15-13-5-3-2-4-12(13)10-14(17-15)16(19)20/h2-5,10-11H,6-9H2,1H3,(H,19,20)