4-[(E)-4-[(2-ethoxy-2-oxidanylidene-ethyl)-phenyl-amino]-4-oxidanylidene-but-2-en-2-yl]benzoic acid

Systemtic Name: 4-[(E)-4-[(2-ethoxy-2-oxidanylidene-ethyl)-phenyl-amino]-4-oxidanylidene-but-2-en-2-yl]benzoic acid Openeye Name: 4-[(E)-3-(N-(2-ethoxy-2-oxo-ethyl)anilino)-1-methyl-3-oxo-prop-1-enyl]benzoic acid CAS Name: 4-[(E)-4-(N-(2-ethoxy-2-oxoethyl)anilino)-4-oxobut-2-en-2-yl]benzoic acid IUPAC Name: 4-[(E)-4-(N-(2-ethoxy-2-oxoethyl)anilino)-4-oxobut-2-en-2-yl]benzoic acid Traditional Name: 4-[(E)-3-(N-(2-ethoxy-2-keto-ethyl)anilino)-3-keto-1-methyl-prop-1-enyl]benzoic acid Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C1=CC=CC=C1)C(=O)C=C(C)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCOC(=O)CN(C1=CC=CC=C1)C(=O)/C=C(\C)/C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C21H21NO5/c1-3-27-20(24)14-22(18-7-5-4-6-8-18)19(23)13-15(2)16-9-11-17(12-10-16)21(25)26/h4-13H,3,14H2,1-2H3,(H,25,26)/b15-13+