methyl 4-[[1-(5-methoxy-2-methyl-phenyl)sulfonylpyrrolidin-2-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[1-(5-methoxy-2-methyl-phenyl)sulfonylpyrrolidin-2-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[1-(5-methoxy-2-methyl-phenyl)sulfonylpyrrolidine-2-carbonyl]amino]benzoate CAS Name: 4-[[[1-(5-methoxy-2-methylphenyl)sulfonyl-2-pyrrolidinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[1-(5-methoxy-2-methylphenyl)sulfonylpyrrolidine-2-carbonyl]amino]benzoate Traditional Name: 4-[[1-(5-methoxy-2-methyl-phenyl)sulfonylprolyl]amino]benzoic acid methyl ester Formula: C21H24N2O6S MolecularWeight: 432.49006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC)S(=O)(=O)N2CCCC2C(=O)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=C(C=C(C=C1)OC)S(=O)(=O)N2CCCC2C(=O)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H24N2O6S/c1-14-6-11-17(28-2)13-19(14)30(26,27)23-12-4-5-18(23)20(24)22-16-9-7-15(8-10-16)21(25)29-3/h6-11,13,18H,4-5,12H2,1-3H3,(H,22,24)