4-[(4-dimethylaminophenyl)methyl-methylsulfonyl-amino]butanoate

Systemtic Name: 4-[(4-dimethylaminophenyl)methyl-methylsulfonyl-amino]butanoate Openeye Name: 4-[(4-dimethylaminophenyl)methyl-methylsulfonyl-amino]butanoate CAS Name: 4-[(4-dimethylaminophenyl)methyl-methylsulfonylamino]butanoate IUPAC Name: 4-[(4-dimethylaminophenyl)methyl-methylsulfonylamino]butanoate Traditional Name: 4-[[4-(dimethylamino)benzyl]-mesyl-amino]butyrate Formula: C14H21N2O4S- MolecularWeight: 313.39254

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CN(CCCC(=O)[O-])S(=O)(=O)C

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CN(CCCC(=O)[O-])S(=O)(=O)C

InChI

InChI=1S/C14H22N2O4S/c1-15(2)13-8-6-12(7-9-13)11-16(21(3,19)20)10-4-5-14(17)18/h6-9H,4-5,10-11H2,1-3H3,(H,17,18)/p-1