[(phenylmethyl)amino] 4-methylsulfonylbutanoate

Systemtic Name: [(phenylmethyl)amino] 4-methylsulfonylbutanoate Openeye Name: (benzylamino) 4-methylsulfonylbutanoate CAS Name: 4-methylsulfonylbutanoic acid [(phenylmethyl)amino] ester IUPAC Name: (benzylamino) 4-methylsulfonylbutanoate Traditional Name: 4-mesylbutyric acid (benzylamino) ester Formula: C12H17NO4S MolecularWeight: 271.33268

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCCC(=O)ONCC1=CC=CC=C1

Isomeric SMILES

CS(=O)(=O)CCCC(=O)ONCC1=CC=CC=C1

InChI

InChI=1S/C12H17NO4S/c1-18(15,16)9-5-8-12(14)17-13-10-11-6-3-2-4-7-11/h2-4,6-7,13H,5,8-10H2,1H3