4-[[4-[2,3-bis(oxidanyl)propoxy]acridin-9-yl]amino]benzoic acid

Systemtic Name: 4-[[4-[2,3-bis(oxidanyl)propoxy]acridin-9-yl]amino]benzoic acid Openeye Name: 4-[[4-(2,3-dihydroxypropoxy)acridin-9-yl]amino]benzoic acid CAS Name: 4-[[4-(2,3-dihydroxypropoxy)-9-acridinyl]amino]benzoic acid IUPAC Name: 4-[[4-(2,3-dihydroxypropoxy)acridin-9-yl]amino]benzoic acid Traditional Name: 4-[(4-glyceryloxyacridin-9-yl)amino]benzoic acid Formula: C23H20N2O5 MolecularWeight: 404.4153

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=C(C3=N2)OCC(CO)O)NC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=C(C3=N2)OCC(CO)O)NC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C23H20N2O5/c26-12-16(27)13-30-20-7-3-5-18-21(17-4-1-2-6-19(17)25-22(18)20)24-15-10-8-14(9-11-15)23(28)29/h1-11,16,26-27H,12-13H2,(H,24,25)(H,28,29)