4-azanyl-2-cyano-3-(3-methoxy-4-oxidanyl-phenyl)-5-prop-2-enoyl-benzenesulfonamide

Systemtic Name: 4-azanyl-2-cyano-3-(3-methoxy-4-oxidanyl-phenyl)-5-prop-2-enoyl-benzenesulfonamide Openeye Name: 4-amino-2-cyano-3-(4-hydroxy-3-methoxy-phenyl)-5-prop-2-enoyl-benzenesulfonamide CAS Name: 4-amino-2-cyano-3-(4-hydroxy-3-methoxyphenyl)-5-(1-oxoprop-2-enyl)benzenesulfonamide IUPAC Name: 4-amino-2-cyano-3-(4-hydroxy-3-methoxyphenyl)-5-prop-2-enoylbenzenesulfonamide Traditional Name: 5-acryloyl-4-amino-2-cyano-3-(4-hydroxy-3-methoxy-phenyl)benzenesulfonamide Formula: C17H15N3O5S MolecularWeight: 373.3831

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=C(C(=CC(=C2C#N)S(=O)(=O)N)C(=O)C=C)N)O

Isomeric SMILES

COC1=C(C=CC(=C1)C2=C(C(=CC(=C2C#N)S(=O)(=O)N)C(=O)C=C)N)O

InChI

InChI=1S/C17H15N3O5S/c1-3-12(21)10-7-15(26(20,23)24)11(8-18)16(17(10)19)9-4-5-13(22)14(6-9)25-2/h3-7,22H,1,19H2,2H3,(H2,20,23,24)