(2,6-dimethyl-4-nitro-phenyl) 7-methoxy-10-methyl-1-(2-oxidanylidene-2-phenylmethoxy-ethoxy)acridin-10-ium-9-carboxylate

Systemtic Name: (2,6-dimethyl-4-nitro-phenyl) 7-methoxy-10-methyl-1-(2-oxidanylidene-2-phenylmethoxy-ethoxy)acridin-10-ium-9-carboxylate Openeye Name: (2,6-dimethyl-4-nitro-phenyl) 1-(2-benzyloxy-2-oxo-ethoxy)-7-methoxy-10-methyl-acridin-10-ium-9-carboxylate CAS Name: 7-methoxy-10-methyl-1-(2-oxo-2-phenylmethoxyethoxy)-9-acridin-10-iumcarboxylic acid (2,6-dimethyl-4-nitrophenyl) ester IUPAC Name: (2,6-dimethyl-4-nitrophenyl) 7-methoxy-10-methyl-1-(2-oxo-2-phenylmethoxyethoxy)acridin-10-ium-9-carboxylate Traditional Name: 1-(2-benzoxy-2-keto-ethoxy)-7-methoxy-10-methyl-acridin-10-ium-9-carboxylic acid (2,6-dimethyl-4-nitro-phenyl) ester Formula: C33H29N2O8+ MolecularWeight: 581.59196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(=O)C2=C3C=C(C=CC3=[N+](C4=C2C(=CC=C4)OCC(=O)OCC5=CC=CC=C5)C)OC)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1OC(=O)C2=C3C=C(C=CC3=[N+](C4=C2C(=CC=C4)OCC(=O)OCC5=CC=CC=C5)C)OC)C)[N+](=O)[O-]

InChI

InChI=1S/C33H29N2O8/c1-20-15-23(35(38)39)16-21(2)32(20)43-33(37)30-25-17-24(40-4)13-14-26(25)34(3)27-11-8-12-28(31(27)30)41-19-29(36)42-18-22-9-6-5-7-10-22/h5-17H,18-19H2,1-4H3/q+1