[7-(3-methylphenyl)-2-oxidanylidene-1,3-benzoxathiol-5-yl] 4-ethoxybenzoate

Systemtic Name: [7-(3-methylphenyl)-2-oxidanylidene-1,3-benzoxathiol-5-yl] 4-ethoxybenzoate Openeye Name: [7-(m-tolyl)-2-oxo-1,3-benzoxathiol-5-yl] 4-ethoxybenzoate CAS Name: 4-ethoxybenzoic acid [7-(3-methylphenyl)-2-oxo-1,3-benzoxathiol-5-yl] ester IUPAC Name: [7-(3-methylphenyl)-2-oxo-1,3-benzoxathiol-5-yl] 4-ethoxybenzoate Traditional Name: 4-ethoxybenzoic acid [2-keto-7-(m-tolyl)-1,3-benzoxathiol-5-yl] ester Formula: C23H18O5S MolecularWeight: 406.45102

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)OC2=CC3=C(C(=C2)C4=CC(=CC=C4)C)OC(=O)S3

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)OC2=CC3=C(C(=C2)C4=CC(=CC=C4)C)OC(=O)S3

InChI

InChI=1S/C23H18O5S/c1-3-26-17-9-7-15(8-10-17)22(24)27-18-12-19(16-6-4-5-14(2)11-16)21-20(13-18)29-23(25)28-21/h4-13H,3H2,1-2H3