2-[[4-[(1-oxidanylidene-3-phenyl-3,4-dihydroisochromen-6-yl)carbonylamino]phenyl]sulfonylamino]ethanoic acid

Systemtic Name: 2-[[4-[(1-oxidanylidene-3-phenyl-3,4-dihydroisochromen-6-yl)carbonylamino]phenyl]sulfonylamino]ethanoic acid Openeye Name: 2-[[4-[(1-oxo-3-phenyl-isochromane-6-carbonyl)amino]phenyl]sulfonylamino]acetic acid CAS Name: 2-[[4-[[oxo-(1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-yl)methyl]amino]phenyl]sulfonylamino]acetic acid IUPAC Name: 2-[[4-[(1-oxo-3-phenyl-3,4-dihydroisochromene-6-carbonyl)amino]phenyl]sulfonylamino]acetic acid Traditional Name: 2-[[4-[(1-keto-3-phenyl-isochroman-6-carbonyl)amino]phenyl]sulfonylamino]acetic acid Formula: C24H20N2O7S MolecularWeight: 480.4898

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C2=C1C=C(C=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NCC(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1C(OC(=O)C2=C1C=C(C=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NCC(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C24H20N2O7S/c27-22(28)14-25-34(31,32)19-9-7-18(8-10-19)26-23(29)16-6-11-20-17(12-16)13-21(33-24(20)30)15-4-2-1-3-5-15/h1-12,21,25H,13-14H2,(H,26,29)(H,27,28)