methyl 4-[[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidin-1-yl-phenyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidin-1-yl-phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidin-1-yl-anilino]-4-oxo-butanoate CAS Name: 4-[5-[(4-methoxyphenyl)sulfamoyl]-2-(1-pyrrolidinyl)anilino]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidin-1-ylanilino]-4-oxobutanoate Traditional Name: 4-keto-4-[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidino-anilino]butyric acid methyl ester Formula: C22H27N3O6S MolecularWeight: 461.53128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)N3CCCC3)NC(=O)CCC(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)N3CCCC3)NC(=O)CCC(=O)OC

InChI

InChI=1S/C22H27N3O6S/c1-30-17-7-5-16(6-8-17)24-32(28,29)18-9-10-20(25-13-3-4-14-25)19(15-18)23-21(26)11-12-22(27)31-2/h5-10,15,24H,3-4,11-14H2,1-2H3,(H,23,26)