(E)-2-(4-methylphenyl)sulfonyl-3-[1-(2-methylpropyl)-3,4-dihydro-2H-quinolin-6-yl]prop-2-enenitrile

Systemtic Name: (E)-2-(4-methylphenyl)sulfonyl-3-[1-(2-methylpropyl)-3,4-dihydro-2H-quinolin-6-yl]prop-2-enenitrile Openeye Name: (E)-3-(1-isobutyl-3,4-dihydro-2H-quinolin-6-yl)-2-(p-tolylsulfonyl)prop-2-enenitrile CAS Name: (E)-2-(4-methylphenyl)sulfonyl-3-[1-(2-methylpropyl)-3,4-dihydro-2H-quinolin-6-yl]-2-propenenitrile IUPAC Name: (E)-2-(4-methylphenyl)sulfonyl-3-[1-(2-methylpropyl)-3,4-dihydro-2H-quinolin-6-yl]prop-2-enenitrile Traditional Name: (E)-3-(1-isobutyl-3,4-dihydro-2H-quinolin-6-yl)-2-tosyl-acrylonitrile Formula: C23H26N2O2S MolecularWeight: 394.52974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=CC3=C(C=C2)N(CCC3)CC(C)C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/C(=C/C2=CC3=C(C=C2)N(CCC3)CC(C)C)/C#N

InChI

InChI=1S/C23H26N2O2S/c1-17(2)16-25-12-4-5-20-13-19(8-11-23(20)25)14-22(15-24)28(26,27)21-9-6-18(3)7-10-21/h6-11,13-14,17H,4-5,12,16H2,1-3H3/b22-14+