1-[cyclopentyl(ethyl)amino]isoquinoline-3-carboxylic acid

Systemtic Name: 1-[cyclopentyl(ethyl)amino]isoquinoline-3-carboxylic acid Openeye Name: 1-[cyclopentyl(ethyl)amino]isoquinoline-3-carboxylic acid CAS Name: 1-[cyclopentyl(ethyl)amino]-3-isoquinolinecarboxylic acid IUPAC Name: 1-[cyclopentyl(ethyl)amino]isoquinoline-3-carboxylic acid Traditional Name: 1-[cyclopentyl(ethyl)amino]isoquinoline-3-carboxylic acid Formula: C17H20N2O2 MolecularWeight: 284.3529

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCCC1)C2=NC(=CC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CCN(C1CCCC1)C2=NC(=CC3=CC=CC=C32)C(=O)O

InChI

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