3-(4-methoxy-3-nitro-phenyl)-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile

Systemtic Name: 3-(4-methoxy-3-nitro-phenyl)-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile Openeye Name: 3-(4-methoxy-3-nitro-phenyl)-2-(p-tolylsulfonyl)prop-2-enenitrile CAS Name: 3-(4-methoxy-3-nitrophenyl)-2-(4-methylphenyl)sulfonyl-2-propenenitrile IUPAC Name: 3-(4-methoxy-3-nitrophenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile Traditional Name: 3-(4-methoxy-3-nitro-phenyl)-2-tosyl-acrylonitrile Formula: C17H14N2O5S MolecularWeight: 358.36846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=CC(=C(C=C2)OC)[N+](=O)[O-])C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=CC(=C(C=C2)OC)[N+](=O)[O-])C#N

InChI

InChI=1S/C17H14N2O5S/c1-12-3-6-14(7-4-12)25(22,23)15(11-18)9-13-5-8-17(24-2)16(10-13)19(20)21/h3-10H,1-2H3