[4-(4-acridin-9-ylcarbonyloxy-3,5-dimethyl-phenyl)sulfonyl-2,6-dimethyl-phenyl] acridine-9-carboxylate

Systemtic Name: [4-(4-acridin-9-ylcarbonyloxy-3,5-dimethyl-phenyl)sulfonyl-2,6-dimethyl-phenyl] acridine-9-carboxylate Openeye Name: [4-[4-(acridine-9-carbonyloxy)-3,5-dimethyl-phenyl]sulfonyl-2,6-dimethyl-phenyl] acridine-9-carboxylate CAS Name: 9-acridinecarboxylic acid [4-[4-[9-acridinyl(oxo)methoxy]-3,5-dimethylphenyl]sulfonyl-2,6-dimethylphenyl] ester IUPAC Name: [4-[4-(acridine-9-carbonyloxy)-3,5-dimethylphenyl]sulfonyl-2,6-dimethylphenyl] acridine-9-carboxylate Traditional Name: acridine-9-carboxylic acid [4-[4-(acridine-9-carbonyloxy)-3,5-dimethyl-phenyl]sulfonyl-2,6-dimethyl-phenyl] ester Formula: C44H32N2O6S MolecularWeight: 716.79968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(=O)C2=C3C=CC=CC3=NC4=CC=CC=C42)C)S(=O)(=O)C5=CC(=C(C(=C5)C)OC(=O)C6=C7C=CC=CC7=NC8=CC=CC=C86)C

Isomeric SMILES

CC1=CC(=CC(=C1OC(=O)C2=C3C=CC=CC3=NC4=CC=CC=C42)C)S(=O)(=O)C5=CC(=C(C(=C5)C)OC(=O)C6=C7C=CC=CC7=NC8=CC=CC=C86)C

InChI

InChI=1S/C44H32N2O6S/c1-25-21-29(22-26(2)41(25)51-43(47)39-31-13-5-9-17-35(31)45-36-18-10-6-14-32(36)39)53(49,50)30-23-27(3)42(28(4)24-30)52-44(48)40-33-15-7-11-19-37(33)46-38-20-12-8-16-34(38)40/h5-24H,1-4H3