3-methyl-4-[2-[methyl-[(E)-2-phenylethenyl]sulfonyl-amino]ethanoylamino]benzoic acid

Systemtic Name: 3-methyl-4-[2-[methyl-[(E)-2-phenylethenyl]sulfonyl-amino]ethanoylamino]benzoic acid Openeye Name: 3-methyl-4-[[2-[methyl-[(E)-styryl]sulfonyl-amino]acetyl]amino]benzoic acid CAS Name: 3-methyl-4-[[2-[methyl-[(E)-2-phenylethenyl]sulfonylamino]-1-oxoethyl]amino]benzoic acid IUPAC Name: 3-methyl-4-[[2-[methyl-[(E)-2-phenylethenyl]sulfonylamino]acetyl]amino]benzoic acid Traditional Name: 3-methyl-4-[[2-[methyl-[(E)-styryl]sulfonyl-amino]acetyl]amino]benzoic acid Formula: C19H20N2O5S MolecularWeight: 388.4375

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)CN(C)S(=O)(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)CN(C)S(=O)(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C19H20N2O5S/c1-14-12-16(19(23)24)8-9-17(14)20-18(22)13-21(2)27(25,26)11-10-15-6-4-3-5-7-15/h3-12H,13H2,1-2H3,(H,20,22)(H,23,24)/b11-10+