methyl 4-[(E)-[5-(2,4-dimethylphenyl)-2-oxidanylidene-furan-3-ylidene]methyl]benzoate

Systemtic Name: methyl 4-[(E)-[5-(2,4-dimethylphenyl)-2-oxidanylidene-furan-3-ylidene]methyl]benzoate Openeye Name: methyl 4-[(E)-[5-(2,4-dimethylphenyl)-2-oxo-3-furylidene]methyl]benzoate CAS Name: 4-[(E)-[5-(2,4-dimethylphenyl)-2-oxo-3-furanylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-[5-(2,4-dimethylphenyl)-2-oxofuran-3-ylidene]methyl]benzoate Traditional Name: 4-[(E)-[5-(2,4-dimethylphenyl)-2-keto-3-furylidene]methyl]benzoic acid methyl ester Formula: C21H18O4 MolecularWeight: 334.36522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CC(=CC3=CC=C(C=C3)C(=O)OC)C(=O)O2)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=C/C(=C\C3=CC=C(C=C3)C(=O)OC)/C(=O)O2)C

InChI

InChI=1S/C21H18O4/c1-13-4-9-18(14(2)10-13)19-12-17(21(23)25-19)11-15-5-7-16(8-6-15)20(22)24-3/h4-12H,1-3H3/b17-11+