[(E)-1-(dimethylamino)-3,5-bis(oxidanylidene)hept-1-en-4-yl] benzoate

Systemtic Name: [(E)-1-(dimethylamino)-3,5-bis(oxidanylidene)hept-1-en-4-yl] benzoate Openeye Name: [(E)-4-(dimethylamino)-2-oxo-1-propanoyl-but-3-enyl] benzoate CAS Name: benzoic acid [(E)-1-(dimethylamino)-3,5-dioxohept-1-en-4-yl] ester IUPAC Name: [(E)-1-(dimethylamino)-3,5-dioxohept-1-en-4-yl] benzoate Traditional Name: benzoic acid [(E)-4-(dimethylamino)-2-keto-1-propionyl-but-3-enyl] ester Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(C(=O)C=CN(C)C)OC(=O)C1=CC=CC=C1

Isomeric SMILES

CCC(=O)C(C(=O)/C=C/N(C)C)OC(=O)C1=CC=CC=C1

InChI

InChI=1S/C16H19NO4/c1-4-13(18)15(14(19)10-11-17(2)3)21-16(20)12-8-6-5-7-9-12/h5-11,15H,4H2,1-3H3/b11-10+