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

Systemtic Name: (E)-4-[(2-dodecylphenyl)amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-(2-dodecylanilino)-4-oxo-but-2-enoic acid CAS Name: (E)-4-(2-dodecylanilino)-4-oxo-2-butenoic acid IUPAC Name: (E)-4-(2-dodecylanilino)-4-oxobut-2-enoic acid Traditional Name: (E)-4-keto-4-(2-laurylanilino)but-2-enoic acid Formula: C22H33NO3 MolecularWeight: 359.50232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC=C1NC(=O)C=CC(=O)O

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC=C1NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C22H33NO3/c1-2-3-4-5-6-7-8-9-10-11-14-19-15-12-13-16-20(19)23-21(24)17-18-22(25)26/h12-13,15-18H,2-11,14H2,1H3,(H,23,24)(H,25,26)/b18-17+