2-[(6-naphthalen-1-ylsulfonyl-3-oxidanyl-quinolin-2-yl)carbonylamino]ethanoic acid

Systemtic Name: 2-[(6-naphthalen-1-ylsulfonyl-3-oxidanyl-quinolin-2-yl)carbonylamino]ethanoic acid Openeye Name: 2-[[3-hydroxy-6-(1-naphthylsulfonyl)quinoline-2-carbonyl]amino]acetic acid CAS Name: 2-[[[3-hydroxy-6-(1-naphthalenylsulfonyl)-2-quinolinyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[(3-hydroxy-6-naphthalen-1-ylsulfonylquinoline-2-carbonyl)amino]acetic acid Traditional Name: 2-[[3-hydroxy-6-(1-naphthylsulfonyl)quinoline-2-carbonyl]amino]acetic acid Formula: C22H16N2O6S MolecularWeight: 436.43724

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2S(=O)(=O)C3=CC4=CC(=C(N=C4C=C3)C(=O)NCC(=O)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2S(=O)(=O)C3=CC4=CC(=C(N=C4C=C3)C(=O)NCC(=O)O)O

InChI

InChI=1S/C22H16N2O6S/c25-18-11-14-10-15(8-9-17(14)24-21(18)22(28)23-12-20(26)27)31(29,30)19-7-3-5-13-4-1-2-6-16(13)19/h1-11,25H,12H2,(H,23,28)(H,26,27)