(E)-4-[[4-(butanoylamino)phenyl]amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[[4-(butanoylamino)phenyl]amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[4-(butanoylamino)anilino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-oxo-4-[4-(1-oxobutylamino)anilino]-2-butenoic acid IUPAC Name: (E)-4-[4-(butanoylamino)anilino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-(4-butyramidoanilino)-4-keto-but-2-enoic acid Formula: C14H16N2O4 MolecularWeight: 276.28784

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)NC(=O)C=CC(=O)O

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C14H16N2O4/c1-2-3-12(17)15-10-4-6-11(7-5-10)16-13(18)8-9-14(19)20/h4-9H,2-3H2,1H3,(H,15,17)(H,16,18)(H,19,20)/b9-8+