1-(2-ethylpiperidin-1-yl)isoquinoline-3-carboxylic acid

Systemtic Name: 1-(2-ethylpiperidin-1-yl)isoquinoline-3-carboxylic acid Openeye Name: 1-(2-ethyl-1-piperidyl)isoquinoline-3-carboxylic acid CAS Name: 1-(2-ethyl-1-piperidinyl)-3-isoquinolinecarboxylic acid IUPAC Name: 1-(2-ethylpiperidin-1-yl)isoquinoline-3-carboxylic acid Traditional Name: 1-(2-ethylpiperidino)isoquinoline-3-carboxylic acid Formula: C17H20N2O2 MolecularWeight: 284.3529

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C2=NC(=CC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CCC1CCCCN1C2=NC(=CC3=CC=CC=C32)C(=O)O

InChI

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