2-(4-chlorophenyl)sulfanylethyl 4-oxidanylidenechromene-2-carboxylate

Systemtic Name: 2-(4-chlorophenyl)sulfanylethyl 4-oxidanylidenechromene-2-carboxylate Openeye Name: 2-(4-chlorophenyl)sulfanylethyl 4-oxochromene-2-carboxylate CAS Name: 4-oxo-1-benzopyran-2-carboxylic acid 2-[(4-chlorophenyl)thio]ethyl ester IUPAC Name: 2-(4-chlorophenyl)sulfanylethyl 4-oxochromene-2-carboxylate Traditional Name: 4-ketochromene-2-carboxylic acid 2-[(4-chlorophenyl)thio]ethyl ester Formula: C18H13ClO4S MolecularWeight: 360.81142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C=C(O2)C(=O)OCCSC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C=C(O2)C(=O)OCCSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H13ClO4S/c19-12-5-7-13(8-6-12)24-10-9-22-18(21)17-11-15(20)14-3-1-2-4-16(14)23-17/h1-8,11H,9-10H2