methyl 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylmethyl)benzoate

Systemtic Name: methyl 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylmethyl)benzoate Openeye Name: methyl 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylmethyl)benzoate CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylmethyl)benzoic acid methyl ester IUPAC Name: methyl 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylmethyl)benzoate Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylmethyl)benzoic acid methyl ester Formula: C18H19NO4S MolecularWeight: 345.41276

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CS(=O)(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CS(=O)(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C18H19NO4S/c1-23-18(20)16-8-6-14(7-9-16)13-24(21,22)19-11-10-15-4-2-3-5-17(15)12-19/h2-9H,10-13H2,1H3