(E)-4-[[2-methyl-3-(propanoylamino)phenyl]amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[[2-methyl-3-(propanoylamino)phenyl]amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[2-methyl-3-(propanoylamino)anilino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[2-methyl-3-(1-oxopropylamino)anilino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[2-methyl-3-(propanoylamino)anilino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-keto-4-(2-methyl-3-propionamido-anilino)but-2-enoic acid Formula: C14H16N2O4 MolecularWeight: 276.28784

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=CC(=C1C)NC(=O)C=CC(=O)O

Isomeric SMILES

CCC(=O)NC1=CC=CC(=C1C)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C14H16N2O4/c1-3-12(17)15-10-5-4-6-11(9(10)2)16-13(18)7-8-14(19)20/h4-8H,3H2,1-2H3,(H,15,17)(H,16,18)(H,19,20)/b8-7+