(3-chloranyl-1-benzothiophen-2-yl)methyl 2-[2-(dimethylamino)-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: (3-chloranyl-1-benzothiophen-2-yl)methyl 2-[2-(dimethylamino)-2-oxidanylidene-ethoxy]benzoate Openeye Name: (3-chlorobenzothiophen-2-yl)methyl 2-[2-(dimethylamino)-2-oxo-ethoxy]benzoate CAS Name: 2-[2-(dimethylamino)-2-oxoethoxy]benzoic acid (3-chloro-1-benzothiophen-2-yl)methyl ester IUPAC Name: (3-chloro-1-benzothiophen-2-yl)methyl 2-[2-(dimethylamino)-2-oxoethoxy]benzoate Traditional Name: 2-[2-(dimethylamino)-2-keto-ethoxy]benzoic acid (3-chlorobenzothiophen-2-yl)methyl ester Formula: C20H18ClNO4S MolecularWeight: 403.87922

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)COC1=CC=CC=C1C(=O)OCC2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CN(C)C(=O)COC1=CC=CC=C1C(=O)OCC2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C20H18ClNO4S/c1-22(2)18(23)12-25-15-9-5-3-7-13(15)20(24)26-11-17-19(21)14-8-4-6-10-16(14)27-17/h3-10H,11-12H2,1-2H3