3-(4-methylphenyl)-3-[[4-(4-methylpiperidin-1-yl)sulfonylphenyl]carbonylamino]propanoic acid

Systemtic Name: 3-(4-methylphenyl)-3-[[4-(4-methylpiperidin-1-yl)sulfonylphenyl]carbonylamino]propanoic acid Openeye Name: 3-[[4-[(4-methyl-1-piperidyl)sulfonyl]benzoyl]amino]-3-(p-tolyl)propanoic acid CAS Name: 3-(4-methylphenyl)-3-[[[4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-(4-methylphenyl)-3-[[4-(4-methylpiperidin-1-yl)sulfonylbenzoyl]amino]propanoic acid Traditional Name: 3-[[4-(4-methylpiperidino)sulfonylbenzoyl]amino]-3-(p-tolyl)propionic acid Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC(CC(=O)O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC(CC(=O)O)C3=CC=C(C=C3)C

InChI

InChI=1S/C23H28N2O5S/c1-16-3-5-18(6-4-16)21(15-22(26)27)24-23(28)19-7-9-20(10-8-19)31(29,30)25-13-11-17(2)12-14-25/h3-10,17,21H,11-15H2,1-2H3,(H,24,28)(H,26,27)