(4-isoquinolin-1-yl-1-methyl-piperidin-4-yl) benzoate

Systemtic Name: (4-isoquinolin-1-yl-1-methyl-piperidin-4-yl) benzoate Openeye Name: [4-(1-isoquinolyl)-1-methyl-4-piperidyl] benzoate CAS Name: benzoic acid [4-(1-isoquinolinyl)-1-methyl-4-piperidinyl] ester IUPAC Name: (4-isoquinolin-1-yl-1-methylpiperidin-4-yl) benzoate Traditional Name: benzoic acid [4-(1-isoquinolyl)-1-methyl-4-piperidyl] ester Formula: C22H22N2O2 MolecularWeight: 346.42228

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)(C2=NC=CC3=CC=CC=C32)OC(=O)C4=CC=CC=C4

Isomeric SMILES

CN1CCC(CC1)(C2=NC=CC3=CC=CC=C32)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H22N2O2/c1-24-15-12-22(13-16-24,26-21(25)18-8-3-2-4-9-18)20-19-10-6-5-7-17(19)11-14-23-20/h2-11,14H,12-13,15-16H2,1H3