2-[acridin-9-yloxycarbonyl(phenylsulfonyl)amino]ethanoic acid

Systemtic Name: 2-[acridin-9-yloxycarbonyl(phenylsulfonyl)amino]ethanoic acid Openeye Name: 2-[acridin-9-yloxycarbonyl(benzenesulfonyl)amino]acetic acid CAS Name: 2-[[9-acridinyloxy(oxo)methyl]-(benzenesulfonyl)amino]acetic acid IUPAC Name: 2-[acridin-9-yloxycarbonyl(benzenesulfonyl)amino]acetic acid Traditional Name: 2-[acridin-9-yloxycarbonyl(besyl)amino]acetic acid Formula: C22H16N2O6S MolecularWeight: 436.43724

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N(CC(=O)O)C(=O)OC2=C3C=CC=CC3=NC4=CC=CC=C42

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N(CC(=O)O)C(=O)OC2=C3C=CC=CC3=NC4=CC=CC=C42

InChI

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