(6-chloranyl-7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(4-chlorophenyl)sulfonyl-methyl-amino]ethanoate

Systemtic Name: (6-chloranyl-7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(4-chlorophenyl)sulfonyl-methyl-amino]ethanoate Openeye Name: (6-chloro-7-ethyl-2-oxo-chromen-4-yl)methyl 2-[(4-chlorophenyl)sulfonyl-methyl-amino]acetate CAS Name: 2-[(4-chlorophenyl)sulfonyl-methylamino]acetic acid (6-chloro-7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-ethyl-2-oxochromen-4-yl)methyl 2-[(4-chlorophenyl)sulfonyl-methylamino]acetate Traditional Name: 2-[(4-chlorophenyl)sulfonyl-methyl-amino]acetic acid (6-chloro-7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C21H19Cl2NO6S MolecularWeight: 484.34966

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CN(C)S(=O)(=O)C3=CC=C(C=C3)Cl)Cl

Isomeric SMILES

CCC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CN(C)S(=O)(=O)C3=CC=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H19Cl2NO6S/c1-3-13-8-19-17(10-18(13)23)14(9-20(25)30-19)12-29-21(26)11-24(2)31(27,28)16-6-4-15(22)5-7-16/h4-10H,3,11-12H2,1-2H3