methyl 1-[(3-aminophenyl)methylsulfonyl]pyrrolidine-2-carboxylate

Systemtic Name: methyl 1-[(3-aminophenyl)methylsulfonyl]pyrrolidine-2-carboxylate Openeye Name: methyl 1-[(3-aminophenyl)methylsulfonyl]pyrrolidine-2-carboxylate CAS Name: 1-[(3-aminophenyl)methylsulfonyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[(3-aminophenyl)methylsulfonyl]pyrrolidine-2-carboxylate Traditional Name: 1-(3-aminobenzyl)sulfonylpyrrolidine-2-carboxylic acid methyl ester Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCN1S(=O)(=O)CC2=CC(=CC=C2)N

Isomeric SMILES

COC(=O)C1CCCN1S(=O)(=O)CC2=CC(=CC=C2)N

InChI

InChI=1S/C13H18N2O4S/c1-19-13(16)12-6-3-7-15(12)20(17,18)9-10-4-2-5-11(14)8-10/h2,4-5,8,12H,3,6-7,9,14H2,1H3