[2-[(4-methyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-phenyl-1,2,3,4-tetrahydroacridine-9-carboxylate

Systemtic Name: [2-[(4-methyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-phenyl-1,2,3,4-tetrahydroacridine-9-carboxylate Openeye Name: [2-(4-methyl-3-nitro-anilino)-2-oxo-ethyl] 2-phenyl-1,2,3,4-tetrahydroacridine-9-carboxylate CAS Name: 2-phenyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-(4-methyl-3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-methyl-3-nitroanilino)-2-oxoethyl] 2-phenyl-1,2,3,4-tetrahydroacridine-9-carboxylate Traditional Name: 2-phenyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-keto-2-(4-methyl-3-nitro-anilino)ethyl] ester Formula: C29H25N3O5 MolecularWeight: 495.5259

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC(=O)C2=C3CC(CCC3=NC4=CC=CC=C42)C5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC(=O)C2=C3CC(CCC3=NC4=CC=CC=C42)C5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C29H25N3O5/c1-18-11-13-21(16-26(18)32(35)36)30-27(33)17-37-29(34)28-22-9-5-6-10-24(22)31-25-14-12-20(15-23(25)28)19-7-3-2-4-8-19/h2-11,13,16,20H,12,14-15,17H2,1H3,(H,30,33)