methyl 4-[2-[(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: methyl 4-[2-[(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethoxy]benzoate Openeye Name: methyl 4-[2-(2-chloro-5-morpholinosulfonyl-anilino)-2-oxo-ethoxy]benzoate CAS Name: 4-[2-[2-chloro-5-(4-morpholinylsulfonyl)anilino]-2-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(2-chloro-5-morpholin-4-ylsulfonylanilino)-2-oxoethoxy]benzoate Traditional Name: 4-[2-(2-chloro-5-morpholinosulfonyl-anilino)-2-keto-ethoxy]benzoic acid methyl ester Formula: C20H21ClN2O7S MolecularWeight: 468.90794

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)Cl

InChI

InChI=1S/C20H21ClN2O7S/c1-28-20(25)14-2-4-15(5-3-14)30-13-19(24)22-18-12-16(6-7-17(18)21)31(26,27)23-8-10-29-11-9-23/h2-7,12H,8-11,13H2,1H3,(H,22,24)