4-[(4-cyanophenyl)sulfonyl-methyl-amino]butanoic acid

Systemtic Name: 4-[(4-cyanophenyl)sulfonyl-methyl-amino]butanoic acid Openeye Name: 4-[(4-cyanophenyl)sulfonyl-methyl-amino]butanoic acid CAS Name: 4-[(4-cyanophenyl)sulfonyl-methylamino]butanoic acid IUPAC Name: 4-[(4-cyanophenyl)sulfonyl-methylamino]butanoic acid Traditional Name: 4-[(4-cyanophenyl)sulfonyl-methyl-amino]butyric acid Formula: C12H14N2O4S MolecularWeight: 282.31556

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)S(=O)(=O)C1=CC=C(C=C1)C#N

Isomeric SMILES

CN(CCCC(=O)O)S(=O)(=O)C1=CC=C(C=C1)C#N

InChI

InChI=1S/C12H14N2O4S/c1-14(8-2-3-12(15)16)19(17,18)11-6-4-10(9-13)5-7-11/h4-7H,2-3,8H2,1H3,(H,15,16)