2-[[4-methoxy-3-(2-methylpiperidin-1-yl)sulfonyl-phenyl]carbonylamino]terephthalic acid

Systemtic Name: 2-[[4-methoxy-3-(2-methylpiperidin-1-yl)sulfonyl-phenyl]carbonylamino]terephthalic acid Openeye Name: 2-[[4-methoxy-3-[(2-methyl-1-piperidyl)sulfonyl]benzoyl]amino]terephthalic acid CAS Name: 2-[[[4-methoxy-3-[(2-methyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]amino]terephthalic acid IUPAC Name: 2-[[4-methoxy-3-(2-methylpiperidin-1-yl)sulfonylbenzoyl]amino]terephthalic acid Traditional Name: 2-[[4-methoxy-3-(2-methylpiperidino)sulfonyl-benzoyl]amino]terephthalic acid Formula: C22H24N2O8S MolecularWeight: 476.49956

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=C(C=CC(=C3)C(=O)O)C(=O)O)OC

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=C(C=CC(=C3)C(=O)O)C(=O)O)OC

InChI

InChI=1S/C22H24N2O8S/c1-13-5-3-4-10-24(13)33(30,31)19-12-14(7-9-18(19)32-2)20(25)23-17-11-15(21(26)27)6-8-16(17)22(28)29/h6-9,11-13H,3-5,10H2,1-2H3,(H,23,25)(H,26,27)(H,28,29)