4-[[(3S)-1-(4-methoxyphenyl)sulfonylpiperidin-3-yl]carbonylamino]butanoic acid

Systemtic Name: 4-[[(3S)-1-(4-methoxyphenyl)sulfonylpiperidin-3-yl]carbonylamino]butanoic acid Openeye Name: 4-[[(3S)-1-(4-methoxyphenyl)sulfonylpiperidine-3-carbonyl]amino]butanoic acid CAS Name: 4-[[[(3S)-1-(4-methoxyphenyl)sulfonyl-3-piperidinyl]-oxomethyl]amino]butanoic acid IUPAC Name: 4-[[(3S)-1-(4-methoxyphenyl)sulfonylpiperidine-3-carbonyl]amino]butanoic acid Traditional Name: 4-[[(3S)-1-(4-methoxyphenyl)sulfonylnipecotoyl]amino]butyric acid Formula: C17H24N2O6S MolecularWeight: 384.44726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NCCCC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@@H](C2)C(=O)NCCCC(=O)O

InChI

InChI=1S/C17H24N2O6S/c1-25-14-6-8-15(9-7-14)26(23,24)19-11-3-4-13(12-19)17(22)18-10-2-5-16(20)21/h6-9,13H,2-5,10-12H2,1H3,(H,18,22)(H,20,21)/t13-/m0/s1