(2-chlorophenyl)methyl 2-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate

Systemtic Name: (2-chlorophenyl)methyl 2-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate Openeye Name: (2-chlorophenyl)methyl 2-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-1-yl]acetate CAS Name: 2-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid (2-chlorophenyl)methyl ester IUPAC Name: (2-chlorophenyl)methyl 2-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-1-yl]acetate Traditional Name: 2-(2-besyl-3,4-dihydro-1H-isoquinolin-1-yl)acetic acid (2-chlorobenzyl) ester Formula: C24H22ClNO4S MolecularWeight: 455.95378

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C2=CC=CC=C21)CC(=O)OCC3=CC=CC=C3Cl)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(C(C2=CC=CC=C21)CC(=O)OCC3=CC=CC=C3Cl)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H22ClNO4S/c25-22-13-7-5-9-19(22)17-30-24(27)16-23-21-12-6-4-8-18(21)14-15-26(23)31(28,29)20-10-2-1-3-11-20/h1-13,23H,14-17H2