3-(3-ethoxy-5-nitro-4-oxidanyl-phenyl)-2-(phenylsulfonyl)prop-2-enenitrile

Systemtic Name: 3-(3-ethoxy-5-nitro-4-oxidanyl-phenyl)-2-(phenylsulfonyl)prop-2-enenitrile Openeye Name: 2-(benzenesulfonyl)-3-(3-ethoxy-4-hydroxy-5-nitro-phenyl)prop-2-enenitrile CAS Name: 2-(benzenesulfonyl)-3-(3-ethoxy-4-hydroxy-5-nitrophenyl)-2-propenenitrile IUPAC Name: 2-(benzenesulfonyl)-3-(3-ethoxy-4-hydroxy-5-nitrophenyl)prop-2-enenitrile Traditional Name: 2-besyl-3-(3-ethoxy-4-hydroxy-5-nitro-phenyl)acrylonitrile Formula: C17H14N2O6S MolecularWeight: 374.36786

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1O)[N+](=O)[O-])C=C(C#N)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC1=CC(=CC(=C1O)[N+](=O)[O-])C=C(C#N)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H14N2O6S/c1-2-25-16-10-12(9-15(17(16)20)19(21)22)8-14(11-18)26(23,24)13-6-4-3-5-7-13/h3-10,20H,2H2,1H3