[2-(4-methylphenyl)sulfonyl-3,4,7,8-tetrahydro-1H-isoquinolin-5-yl]methyl ethanoate

Systemtic Name: [2-(4-methylphenyl)sulfonyl-3,4,7,8-tetrahydro-1H-isoquinolin-5-yl]methyl ethanoate Openeye Name: [2-(p-tolylsulfonyl)-3,4,7,8-tetrahydro-1H-isoquinolin-5-yl]methyl acetate CAS Name: acetic acid [2-(4-methylphenyl)sulfonyl-3,4,7,8-tetrahydro-1H-isoquinolin-5-yl]methyl ester IUPAC Name: [2-(4-methylphenyl)sulfonyl-3,4,7,8-tetrahydro-1H-isoquinolin-5-yl]methyl acetate Traditional Name: acetic acid (2-tosyl-3,4,7,8-tetrahydro-1H-isoquinolin-5-yl)methyl ester Formula: C19H23NO4S MolecularWeight: 361.45522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2)CCC=C3COC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2)CCC=C3COC(=O)C

InChI

InChI=1S/C19H23NO4S/c1-14-6-8-18(9-7-14)25(22,23)20-11-10-19-16(12-20)4-3-5-17(19)13-24-15(2)21/h5-9H,3-4,10-13H2,1-2H3