(3-oxidanylidenebenzo[f]chromen-1-yl)methyl 2-(3,4-dimethylphenyl)sulfanylethanoate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl 2-(3,4-dimethylphenyl)sulfanylethanoate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl 2-(3,4-dimethylphenyl)sulfanylacetate CAS Name: 2-[(3,4-dimethylphenyl)thio]acetic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl 2-(3,4-dimethylphenyl)sulfanylacetate Traditional Name: 2-[(3,4-dimethylphenyl)thio]acetic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C24H20O4S MolecularWeight: 404.4782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCC(=O)OCC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCC(=O)OCC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3)C

InChI

InChI=1S/C24H20O4S/c1-15-7-9-19(11-16(15)2)29-14-23(26)27-13-18-12-22(25)28-21-10-8-17-5-3-4-6-20(17)24(18)21/h3-12H,13-14H2,1-2H3