(E)-3-[5-(4-chloranyl-2-nitro-phenyl)furan-2-yl]-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[5-(4-chloranyl-2-nitro-phenyl)furan-2-yl]-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile Openeye Name: (E)-3-[5-(4-chloro-2-nitro-phenyl)-2-furyl]-2-(p-tolylsulfonyl)prop-2-enenitrile CAS Name: (E)-3-[5-(4-chloro-2-nitrophenyl)-2-furanyl]-2-(4-methylphenyl)sulfonyl-2-propenenitrile IUPAC Name: (E)-3-[5-(4-chloro-2-nitrophenyl)furan-2-yl]-2-(4-methylphenyl)sulfonylprop-2-enenitrile Traditional Name: (E)-3-[5-(4-chloro-2-nitro-phenyl)-2-furyl]-2-tosyl-acrylonitrile Formula: C20H13ClN2O5S MolecularWeight: 428.84562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=CC=C(O2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-])C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/C(=C/C2=CC=C(O2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-])/C#N

InChI

InChI=1S/C20H13ClN2O5S/c1-13-2-6-16(7-3-13)29(26,27)17(12-22)11-15-5-9-20(28-15)18-8-4-14(21)10-19(18)23(24)25/h2-11H,1H3/b17-11+