methyl 2-[4-methylidene-2-(4-methylphenyl)sulfonyl-1,3-dihydroisoquinolin-1-yl]ethanoate

Systemtic Name: methyl 2-[4-methylidene-2-(4-methylphenyl)sulfonyl-1,3-dihydroisoquinolin-1-yl]ethanoate Openeye Name: methyl 2-[4-methylene-2-(p-tolylsulfonyl)-1,3-dihydroisoquinolin-1-yl]acetate CAS Name: 2-[4-methylene-2-(4-methylphenyl)sulfonyl-1,3-dihydroisoquinolin-1-yl]acetic acid methyl ester IUPAC Name: methyl 2-[4-methylidene-2-(4-methylphenyl)sulfonyl-1,3-dihydroisoquinolin-1-yl]acetate Traditional Name: 2-(4-methylene-2-tosyl-1,3-dihydroisoquinolin-1-yl)acetic acid methyl ester Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(=C)C3=CC=CC=C3C2CC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC(=C)C3=CC=CC=C3C2CC(=O)OC

InChI

InChI=1S/C20H21NO4S/c1-14-8-10-16(11-9-14)26(23,24)21-13-15(2)17-6-4-5-7-18(17)19(21)12-20(22)25-3/h4-11,19H,2,12-13H2,1,3H3