methyl 2-[(E)-3-(1,3-benzodioxol-5-yl)-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 2-[(E)-3-(1,3-benzodioxol-5-yl)-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 2-[(E)-3-(1,3-benzodioxol-5-yl)-3-oxo-prop-1-enyl]benzoate CAS Name: 2-[(E)-3-(1,3-benzodioxol-5-yl)-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(E)-3-(1,3-benzodioxol-5-yl)-3-oxoprop-1-enyl]benzoate Traditional Name: 2-[(E)-3-(1,3-benzodioxol-5-yl)-3-keto-prop-1-enyl]benzoic acid methyl ester Formula: C18H14O5 MolecularWeight: 310.30076

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C=CC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC(=O)C1=CC=CC=C1/C=C/C(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H14O5/c1-21-18(20)14-5-3-2-4-12(14)6-8-15(19)13-7-9-16-17(10-13)23-11-22-16/h2-10H,11H2,1H3/b8-6+