4-[(E)-2-[(2,6-diethylphenyl)carbamoyl]-3-oxidanylidene-3-phenyl-prop-1-enyl]benzoic acid

Systemtic Name: 4-[(E)-2-[(2,6-diethylphenyl)carbamoyl]-3-oxidanylidene-3-phenyl-prop-1-enyl]benzoic acid Openeye Name: 4-[(E)-2-benzoyl-3-(2,6-diethylanilino)-3-oxo-prop-1-enyl]benzoic acid CAS Name: 4-[(E)-2-benzoyl-3-(2,6-diethylanilino)-3-oxoprop-1-enyl]benzoic acid IUPAC Name: 4-[(E)-2-benzoyl-3-(2,6-diethylanilino)-3-oxoprop-1-enyl]benzoic acid Traditional Name: 4-[(E)-2-benzoyl-3-(2,6-diethylanilino)-3-keto-prop-1-enyl]benzoic acid Formula: C27H25NO4 MolecularWeight: 427.4917

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)C(=CC2=CC=C(C=C2)C(=O)O)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)/C(=C/C2=CC=C(C=C2)C(=O)O)/C(=O)C3=CC=CC=C3

InChI

InChI=1S/C27H25NO4/c1-3-19-11-8-12-20(4-2)24(19)28-26(30)23(25(29)21-9-6-5-7-10-21)17-18-13-15-22(16-14-18)27(31)32/h5-17H,3-4H2,1-2H3,(H,28,30)(H,31,32)/b23-17+