(E)-4-oxidanylidene-4-[(5-prop-2-enoxy-2-prop-2-enyl-phenyl)amino]but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-[(5-prop-2-enoxy-2-prop-2-enyl-phenyl)amino]but-2-enoic acid Openeye Name: (E)-4-(2-allyl-5-allyloxy-anilino)-4-oxo-but-2-enoic acid CAS Name: (E)-4-oxo-4-(5-prop-2-enoxy-2-prop-2-enylanilino)-2-butenoic acid IUPAC Name: (E)-4-oxo-4-(5-prop-2-enoxy-2-prop-2-enylanilino)but-2-enoic acid Traditional Name: (E)-4-(2-allyl-5-allyloxy-anilino)-4-keto-but-2-enoic acid Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=C(C=C(C=C1)OCC=C)NC(=O)C=CC(=O)O

Isomeric SMILES

C=CCC1=C(C=C(C=C1)OCC=C)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C16H17NO4/c1-3-5-12-6-7-13(21-10-4-2)11-14(12)17-15(18)8-9-16(19)20/h3-4,6-9,11H,1-2,5,10H2,(H,17,18)(H,19,20)/b9-8+