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

Systemtic Name: [2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-phenyl-1,2,3,4-tetrahydroacridine-9-carboxylate Openeye Name: [2-(4-chloro-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-chloro-3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-chloro-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-(4-chloro-3-nitro-anilino)-2-keto-ethyl] ester Formula: C28H22ClN3O5 MolecularWeight: 515.94438

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=NC3=CC=CC=C3C(=C2CC1C4=CC=CC=C4)C(=O)OCC(=O)NC5=CC(=C(C=C5)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CC2=NC3=CC=CC=C3C(=C2CC1C4=CC=CC=C4)C(=O)OCC(=O)NC5=CC(=C(C=C5)Cl)[N+](=O)[O-]

InChI

InChI=1S/C28H22ClN3O5/c29-22-12-11-19(15-25(22)32(35)36)30-26(33)16-37-28(34)27-20-8-4-5-9-23(20)31-24-13-10-18(14-21(24)27)17-6-2-1-3-7-17/h1-9,11-12,15,18H,10,13-14,16H2,(H,30,33)