(phenylmethyl) 3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-phenyl-pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-phenyl-pyrrolidine-1-carboxylate Openeye Name: benzyl 3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-phenyl-pyrrolidine-1-carboxylate CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-phenyl-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-phenylpyrrolidine-1-carboxylate Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-phenyl-pyrrolidine-1-carboxylic acid benzyl ester Formula: C28H30N2O2 MolecularWeight: 426.55

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CC3CN(CC3C4=CC=CC=C4)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CC3CN(CC3C4=CC=CC=C4)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C28H30N2O2/c31-28(32-21-22-9-3-1-4-10-22)30-19-26(27(20-30)24-12-5-2-6-13-24)18-29-16-15-23-11-7-8-14-25(23)17-29/h1-14,26-27H,15-21H2