(2E)-2-[(3-methylphenyl)-(4-sulfamoylphenyl)methylidene]-4-oxidanyl-butanoic acid

Systemtic Name: (2E)-2-[(3-methylphenyl)-(4-sulfamoylphenyl)methylidene]-4-oxidanyl-butanoic acid Openeye Name: (2E)-4-hydroxy-2-[m-tolyl-(4-sulfamoylphenyl)methylene]butanoic acid CAS Name: (2E)-4-hydroxy-2-[(3-methylphenyl)-(4-sulfamoylphenyl)methylidene]butanoic acid IUPAC Name: (2E)-4-hydroxy-2-[(3-methylphenyl)-(4-sulfamoylphenyl)methylidene]butanoic acid Traditional Name: (E)-2-(2-hydroxyethyl)-3-(m-tolyl)-3-(4-sulfamoylphenyl)acrylic acid Formula: C18H19NO5S MolecularWeight: 361.41216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=C(CCO)C(=O)O)C2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CC1=CC=CC(=C1)/C(=C(\CCO)/C(=O)O)/C2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C18H19NO5S/c1-12-3-2-4-14(11-12)17(16(9-10-20)18(21)22)13-5-7-15(8-6-13)25(19,23)24/h2-8,11,20H,9-10H2,1H3,(H,21,22)(H2,19,23,24)/b17-16+