[(E)-4-(butylamino)-4-oxidanylidene-1-phenyl-but-2-enyl] benzoate

Systemtic Name: [(E)-4-(butylamino)-4-oxidanylidene-1-phenyl-but-2-enyl] benzoate Openeye Name: [(E)-4-(butylamino)-4-oxo-1-phenyl-but-2-enyl] benzoate CAS Name: benzoic acid [(E)-4-(butylamino)-4-oxo-1-phenylbut-2-enyl] ester IUPAC Name: [(E)-4-(butylamino)-4-oxo-1-phenylbut-2-enyl] benzoate Traditional Name: benzoic acid [(E)-4-(butylamino)-4-keto-1-phenyl-but-2-enyl] ester Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C=CC(C1=CC=CC=C1)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCNC(=O)/C=C/C(C1=CC=CC=C1)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H23NO3/c1-2-3-16-22-20(23)15-14-19(17-10-6-4-7-11-17)25-21(24)18-12-8-5-9-13-18/h4-15,19H,2-3,16H2,1H3,(H,22,23)/b15-14+