[7-(ethoxycarbonylamino)-2-oxidanylidene-chromen-4-yl]methyl 2-(2-chlorophenyl)sulfanylethanoate

Systemtic Name: [7-(ethoxycarbonylamino)-2-oxidanylidene-chromen-4-yl]methyl 2-(2-chlorophenyl)sulfanylethanoate Openeye Name: [7-(ethoxycarbonylamino)-2-oxo-chromen-4-yl]methyl 2-(2-chlorophenyl)sulfanylacetate CAS Name: 2-[(2-chlorophenyl)thio]acetic acid [7-(ethoxycarbonylamino)-2-oxo-1-benzopyran-4-yl]methyl ester IUPAC Name: [7-(ethoxycarbonylamino)-2-oxochromen-4-yl]methyl 2-(2-chlorophenyl)sulfanylacetate Traditional Name: 2-[(2-chlorophenyl)thio]acetic acid [7-(carbethoxyamino)-2-keto-chromen-4-yl]methyl ester Formula: C21H18ClNO6S MolecularWeight: 447.88872

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CSC3=CC=CC=C3Cl

Isomeric SMILES

CCOC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CSC3=CC=CC=C3Cl

InChI

InChI=1S/C21H18ClNO6S/c1-2-27-21(26)23-14-7-8-15-13(9-19(24)29-17(15)10-14)11-28-20(25)12-30-18-6-4-3-5-16(18)22/h3-10H,2,11-12H2,1H3,(H,23,26)