methyl (2R)-1-[(E)-N-(4-methylphenyl)sulfonyl-C-propyl-carbonimidoyl]pyrrolidine-2-carboxylate

Systemtic Name: methyl (2R)-1-[(E)-N-(4-methylphenyl)sulfonyl-C-propyl-carbonimidoyl]pyrrolidine-2-carboxylate Openeye Name: methyl (2R)-1-[(E)-C-propyl-N-(p-tolylsulfonyl)carbonimidoyl]pyrrolidine-2-carboxylate CAS Name: (2R)-1-[(1E)-1-(4-methylphenyl)sulfonyliminobutyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-1-[(E)-N-(4-methylphenyl)sulfonyl-C-propylcarbonimidoyl]pyrrolidine-2-carboxylate Traditional Name: (2R)-1-[(E)-C-propyl-N-tosyl-carbonimidoyl]pyrrolidine-2-carboxylic acid methyl ester Formula: C17H24N2O4S MolecularWeight: 352.44846

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=NS(=O)(=O)C1=CC=C(C=C1)C)N2CCCC2C(=O)OC

Isomeric SMILES

CCC/C(=N\S(=O)(=O)C1=CC=C(C=C1)C)/N2CCC[C@@H]2C(=O)OC

InChI

InChI=1S/C17H24N2O4S/c1-4-6-16(19-12-5-7-15(19)17(20)23-3)18-24(21,22)14-10-8-13(2)9-11-14/h8-11,15H,4-7,12H2,1-3H3/b18-16+/t15-/m1/s1