1-(2-methylcyclohexyl)oxyisoquinoline-3-carboxylic acid

Systemtic Name: 1-(2-methylcyclohexyl)oxyisoquinoline-3-carboxylic acid Openeye Name: 1-(2-methylcyclohexoxy)isoquinoline-3-carboxylic acid CAS Name: 1-(2-methylcyclohexyl)oxy-3-isoquinolinecarboxylic acid IUPAC Name: 1-(2-methylcyclohexyl)oxyisoquinoline-3-carboxylic acid Traditional Name: 1-(2-methylcyclohexoxy)isoquinoline-3-carboxylic acid Formula: C17H19NO3 MolecularWeight: 285.33766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1OC2=NC(=CC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC1CCCCC1OC2=NC(=CC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C17H19NO3/c1-11-6-2-5-9-15(11)21-16-13-8-4-3-7-12(13)10-14(18-16)17(19)20/h3-4,7-8,10-11,15H,2,5-6,9H2,1H3,(H,19,20)