2-[(9-acridin-9-yl-2,2-dimethoxy-1H-acridin-4-yl)methyl]benzoic acid

Systemtic Name: 2-[(9-acridin-9-yl-2,2-dimethoxy-1H-acridin-4-yl)methyl]benzoic acid Openeye Name: 2-[(9-acridin-9-yl-2,2-dimethoxy-1H-acridin-4-yl)methyl]benzoic acid CAS Name: 2-[[9-(9-acridinyl)-2,2-dimethoxy-1H-acridin-4-yl]methyl]benzoic acid IUPAC Name: 2-[(9-acridin-9-yl-2,2-dimethoxy-1H-acridin-4-yl)methyl]benzoic acid Traditional Name: 2-[(9-acridin-9-yl-2,2-dimethoxy-1H-acridin-4-yl)methyl]benzoic acid Formula: C36H28N2O4 MolecularWeight: 552.61852

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Descriptors Computed from Structure

Canonical SMILES:

COC1(CC2=C(C3=CC=CC=C3N=C2C(=C1)CC4=CC=CC=C4C(=O)O)C5=C6C=CC=CC6=NC7=CC=CC=C75)OC

Isomeric SMILES

COC1(CC2=C(C3=CC=CC=C3N=C2C(=C1)CC4=CC=CC=C4C(=O)O)C5=C6C=CC=CC6=NC7=CC=CC=C75)OC

InChI

InChI=1S/C36H28N2O4/c1-41-36(42-2)20-23(19-22-11-3-4-12-24(22)35(39)40)34-28(21-36)33(27-15-7-10-18-31(27)38-34)32-25-13-5-8-16-29(25)37-30-17-9-6-14-26(30)32/h3-18,20H,19,21H2,1-2H3,(H,39,40)