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

Systemtic Name: 2-[1-(2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)cyclohexyl]morpholine-4-carboxylic acid Openeye Name: 2-[1-(2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)cyclohexyl]morpholine-4-carboxylic acid CAS Name: 2-[1-(2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)cyclohexyl]-4-morpholinecarboxylic acid IUPAC Name: 2-[1-(2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)cyclohexyl]morpholine-4-carboxylic acid Traditional Name: 2-[1-(2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)cyclohexyl]morpholine-4-carboxylic acid Formula: C21H30N2O3 MolecularWeight: 358.4745

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(C2=CC=CC=C2C1)C3(CCCCC3)C4CN(CCO4)C(=O)O

Isomeric SMILES

CN1CC(C2=CC=CC=C2C1)C3(CCCCC3)C4CN(CCO4)C(=O)O

InChI

InChI=1S/C21H30N2O3/c1-22-13-16-7-3-4-8-17(16)18(14-22)21(9-5-2-6-10-21)19-15-23(20(24)25)11-12-26-19/h3-4,7-8,18-19H,2,5-6,9-15H2,1H3,(H,24,25)