2-[(4-oxidanyl-6,7-diphenoxy-isoquinolin-3-yl)carbonylamino]ethanoic acid

Systemtic Name: 2-[(4-oxidanyl-6,7-diphenoxy-isoquinolin-3-yl)carbonylamino]ethanoic acid Openeye Name: 2-[(4-hydroxy-6,7-diphenoxy-isoquinoline-3-carbonyl)amino]acetic acid CAS Name: 2-[[(4-hydroxy-6,7-diphenoxy-3-isoquinolinyl)-oxomethyl]amino]acetic acid IUPAC Name: 2-[(4-hydroxy-6,7-diphenoxyisoquinoline-3-carbonyl)amino]acetic acid Traditional Name: 2-[(4-hydroxy-6,7-diphenoxy-isoquinoline-3-carbonyl)amino]acetic acid Formula: C24H18N2O6 MolecularWeight: 430.40952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C=C3C(=C2)C=NC(=C3O)C(=O)NCC(=O)O)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C=C3C(=C2)C=NC(=C3O)C(=O)NCC(=O)O)OC4=CC=CC=C4

InChI

InChI=1S/C24H18N2O6/c27-21(28)14-26-24(30)22-23(29)18-12-20(32-17-9-5-2-6-10-17)19(11-15(18)13-25-22)31-16-7-3-1-4-8-16/h1-13,29H,14H2,(H,26,30)(H,27,28)