(2-methylphenyl) 10-(2-oxidanylidene-2-phenylmethoxy-ethyl)acridin-10-ium-9-carboxylate

Systemtic Name: (2-methylphenyl) 10-(2-oxidanylidene-2-phenylmethoxy-ethyl)acridin-10-ium-9-carboxylate Openeye Name: o-tolyl 10-(2-benzyloxy-2-oxo-ethyl)acridin-10-ium-9-carboxylate CAS Name: 10-(2-oxo-2-phenylmethoxyethyl)-9-acridin-10-iumcarboxylic acid (2-methylphenyl) ester IUPAC Name: (2-methylphenyl) 10-(2-oxo-2-phenylmethoxyethyl)acridin-10-ium-9-carboxylate Traditional Name: 10-(2-benzoxy-2-keto-ethyl)acridin-10-ium-9-carboxylic acid o-tolyl ester Formula: C30H24NO4+ MolecularWeight: 462.51586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC(=O)C2=C3C=CC=CC3=[N+](C4=CC=CC=C42)CC(=O)OCC5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC=C1OC(=O)C2=C3C=CC=CC3=[N+](C4=CC=CC=C42)CC(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C30H24NO4/c1-21-11-5-10-18-27(21)35-30(33)29-23-14-6-8-16-25(23)31(26-17-9-7-15-24(26)29)19-28(32)34-20-22-12-3-2-4-13-22/h2-18H,19-20H2,1H3/q+1