[2,6-dimethyl-4-(phenylcarbonyloxycarbonyl)phenyl] 10-methyl-2-oxidanyl-acridin-10-ium-9-carboxylate

Systemtic Name: [2,6-dimethyl-4-(phenylcarbonyloxycarbonyl)phenyl] 10-methyl-2-oxidanyl-acridin-10-ium-9-carboxylate Openeye Name: (4-benzoyloxycarbonyl-2,6-dimethyl-phenyl) 2-hydroxy-10-methyl-acridin-10-ium-9-carboxylate CAS Name: 2-hydroxy-10-methyl-9-acridin-10-iumcarboxylic acid [4-[benzoyloxy(oxo)methyl]-2,6-dimethylphenyl] ester IUPAC Name: (4-benzoyloxycarbonyl-2,6-dimethylphenyl) 2-hydroxy-10-methylacridin-10-ium-9-carboxylate Traditional Name: 2-hydroxy-10-methyl-acridin-10-ium-9-carboxylic acid (4-benzoyloxycarbonyl-2,6-dimethyl-phenyl) ester Formula: C31H24NO6+ MolecularWeight: 506.52536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(=O)C2=C3C=C(C=CC3=[N+](C4=CC=CC=C42)C)O)C)C(=O)OC(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=CC(=C1OC(=O)C2=C3C=C(C=CC3=[N+](C4=CC=CC=C42)C)O)C)C(=O)OC(=O)C5=CC=CC=C5

InChI

InChI=1S/C31H23NO6/c1-18-15-21(30(35)38-29(34)20-9-5-4-6-10-20)16-19(2)28(18)37-31(36)27-23-11-7-8-12-25(23)32(3)26-14-13-22(33)17-24(26)27/h4-17H,1-3H3/p+1