methyl 4-methyl-3-[2-(propylcarbamoyl)pyrrolidin-1-yl]sulfonyl-benzoate

Systemtic Name: methyl 4-methyl-3-[2-(propylcarbamoyl)pyrrolidin-1-yl]sulfonyl-benzoate Openeye Name: methyl 4-methyl-3-[2-(propylcarbamoyl)pyrrolidin-1-yl]sulfonyl-benzoate CAS Name: 4-methyl-3-[[2-[oxo(propylamino)methyl]-1-pyrrolidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[2-(propylcarbamoyl)pyrrolidin-1-yl]sulfonylbenzoate Traditional Name: 4-methyl-3-[2-(propylcarbamoyl)pyrrolidino]sulfonyl-benzoic acid methyl ester Formula: C17H24N2O5S MolecularWeight: 368.44786

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1CCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC)C

Isomeric SMILES

CCCNC(=O)C1CCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC)C

InChI

InChI=1S/C17H24N2O5S/c1-4-9-18-16(20)14-6-5-10-19(14)25(22,23)15-11-13(17(21)24-3)8-7-12(15)2/h7-8,11,14H,4-6,9-10H2,1-3H3,(H,18,20)