methyl 4-[[3-(3,4-dihydro-1H-isoquinolin-2-yl)piperidin-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[3-(3,4-dihydro-1H-isoquinolin-2-yl)piperidin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-piperidyl]methyl]benzoate CAS Name: 4-[[3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-piperidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(3,4-dihydro-1H-isoquinolin-2-yl)piperidin-1-yl]methyl]benzoate Traditional Name: 4-[[3-(3,4-dihydro-1H-isoquinolin-2-yl)piperidino]methyl]benzoic acid methyl ester Formula: C23H28N2O2 MolecularWeight: 364.48062

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN2CCCC(C2)N3CCC4=CC=CC=C4C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN2CCCC(C2)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H28N2O2/c1-27-23(26)20-10-8-18(9-11-20)15-24-13-4-7-22(17-24)25-14-12-19-5-2-3-6-21(19)16-25/h2-3,5-6,8-11,22H,4,7,12-17H2,1H3