(4-carbonochloridoylphenyl) 4-[(E)-3-butoxy-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: (4-carbonochloridoylphenyl) 4-[(E)-3-butoxy-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: (4-chlorocarbonylphenyl) 4-[(E)-3-butoxy-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-butoxy-3-oxoprop-1-enyl]benzoic acid (4-carbonochloridoylphenyl) ester IUPAC Name: (4-carbonochloridoylphenyl) 4-[(E)-3-butoxy-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-butoxy-3-keto-prop-1-enyl]benzoic acid (4-chlorocarbonylphenyl) ester Formula: C21H19ClO5 MolecularWeight: 386.82556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C=CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)Cl

Isomeric SMILES

CCCCOC(=O)/C=C/C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)Cl

InChI

InChI=1S/C21H19ClO5/c1-2-3-14-26-19(23)13-6-15-4-7-17(8-5-15)21(25)27-18-11-9-16(10-12-18)20(22)24/h4-13H,2-3,14H2,1H3/b13-6+