(3-oxidanylidenebenzo[f]chromen-1-yl)methyl 4-[(4-chlorophenyl)sulfanylmethyl]benzoate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl 4-[(4-chlorophenyl)sulfanylmethyl]benzoate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl 4-[(4-chlorophenyl)sulfanylmethyl]benzoate CAS Name: 4-[[(4-chlorophenyl)thio]methyl]benzoic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl 4-[(4-chlorophenyl)sulfanylmethyl]benzoate Traditional Name: 4-[[(4-chlorophenyl)thio]methyl]benzoic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C28H19ClO4S MolecularWeight: 486.96606

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2C(=CC(=O)O3)COC(=O)C4=CC=C(C=C4)CSC5=CC=C(C=C5)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2C(=CC(=O)O3)COC(=O)C4=CC=C(C=C4)CSC5=CC=C(C=C5)Cl

InChI

InChI=1S/C28H19ClO4S/c29-22-10-12-23(13-11-22)34-17-18-5-7-20(8-6-18)28(31)32-16-21-15-26(30)33-25-14-9-19-3-1-2-4-24(19)27(21)25/h1-15H,16-17H2