(E)-3-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-N-(3-methylsulfonylphenyl)prop-2-enamide

Systemtic Name: (E)-3-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-N-(3-methylsulfonylphenyl)prop-2-enamide Openeye Name: (E)-3-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-N-(3-methylsulfonylphenyl)prop-2-enamide CAS Name: (E)-3-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-N-(3-methylsulfonylphenyl)-2-propenamide IUPAC Name: (E)-3-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-N-(3-methylsulfonylphenyl)prop-2-enamide Traditional Name: (E)-N-(3-mesylphenyl)-3-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)acrylamide Formula: C20H22N2O3S MolecularWeight: 370.46528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C1)C=C(C=C2)C=CC(=O)NC3=CC(=CC=C3)S(=O)(=O)C

Isomeric SMILES

CN1CCC2=C(C1)C=C(C=C2)/C=C/C(=O)NC3=CC(=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C20H22N2O3S/c1-22-11-10-16-8-6-15(12-17(16)14-22)7-9-20(23)21-18-4-3-5-19(13-18)26(2,24)25/h3-9,12-13H,10-11,14H2,1-2H3,(H,21,23)/b9-7+