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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=NC(=CC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC1CCCN(C1)C2=NC(=CC3=CC=CC=C32)C(=O)O

InChI

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