methyl 2-[4-methyl-1-(4-methylphenyl)sulfonyl-2H-quinolin-2-yl]ethanoate

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(C=C(C3=CC=CC=C32)C)CC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(C=C(C3=CC=CC=C32)C)CC(=O)OC

InChI

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