4-[(3-chlorophenyl)methyl-methylsulfonyl-amino]butanoate

Systemtic Name: 4-[(3-chlorophenyl)methyl-methylsulfonyl-amino]butanoate Openeye Name: 4-[(3-chlorophenyl)methyl-methylsulfonyl-amino]butanoate CAS Name: 4-[(3-chlorophenyl)methyl-methylsulfonylamino]butanoate IUPAC Name: 4-[(3-chlorophenyl)methyl-methylsulfonylamino]butanoate Traditional Name: 4-[(3-chlorobenzyl)-mesyl-amino]butyrate Formula: C12H15ClNO4S- MolecularWeight: 304.7698

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCC(=O)[O-])CC1=CC(=CC=C1)Cl

Isomeric SMILES

CS(=O)(=O)N(CCCC(=O)[O-])CC1=CC(=CC=C1)Cl

InChI

InChI=1S/C12H16ClNO4S/c1-19(17,18)14(7-3-6-12(15)16)9-10-4-2-5-11(13)8-10/h2,4-5,8H,3,6-7,9H2,1H3,(H,15,16)/p-1