1-[1-(2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)cyclohexyl]cyclopropane-1-carboxylic acid

Systemtic Name: 1-[1-(2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)cyclohexyl]cyclopropane-1-carboxylic acid Openeye Name: 1-[1-(2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)cyclohexyl]cyclopropanecarboxylic acid CAS Name: 1-[1-(2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)cyclohexyl]-1-cyclopropanecarboxylic acid IUPAC Name: 1-[1-(2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)cyclohexyl]cyclopropane-1-carboxylic acid Traditional Name: 1-[1-(2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)cyclohexyl]cyclopropanecarboxylic acid Formula: C20H27NO2 MolecularWeight: 313.43388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CC(C2=CC=CC=C2C1)C3(CCCCC3)C4(CC4)C(=O)O

Isomeric SMILES

CN1CC(C2=CC=CC=C2C1)C3(CCCCC3)C4(CC4)C(=O)O

InChI

InChI=1S/C20H27NO2/c1-21-13-15-7-3-4-8-16(15)17(14-21)19(9-5-2-6-10-19)20(11-12-20)18(22)23/h3-4,7-8,17H,2,5-6,9-14H2,1H3,(H,22,23)