2-[[1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidin-4-yl]carbonylamino]terephthalic acid

Systemtic Name: 2-[[1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidin-4-yl]carbonylamino]terephthalic acid Openeye Name: 2-[(1-indan-5-ylsulfonylpiperidine-4-carbonyl)amino]terephthalic acid CAS Name: 2-[[[1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-4-piperidinyl]-oxomethyl]amino]terephthalic acid IUPAC Name: 2-[[1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidine-4-carbonyl]amino]terephthalic acid Traditional Name: 2-[(1-indan-5-ylsulfonylisonipecotoyl)amino]terephthalic acid Formula: C23H24N2O7S MolecularWeight: 472.51086

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCC(CC3)C(=O)NC4=C(C=CC(=C4)C(=O)O)C(=O)O

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCC(CC3)C(=O)NC4=C(C=CC(=C4)C(=O)O)C(=O)O

InChI

InChI=1S/C23H24N2O7S/c26-21(24-20-13-17(22(27)28)5-7-19(20)23(29)30)15-8-10-25(11-9-15)33(31,32)18-6-4-14-2-1-3-16(14)12-18/h4-7,12-13,15H,1-3,8-11H2,(H,24,26)(H,27,28)(H,29,30)