[1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylate

Systemtic Name: [1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylate Openeye Name: [1-methyl-2-(2-nitroanilino)-2-oxo-ethyl] 2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylate CAS Name: 2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid [1-(2-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-nitroanilino)-1-oxopropan-2-yl] 2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylate Traditional Name: 2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-keto-1-methyl-2-(2-nitroanilino)ethyl] ester Formula: C27H29N3O5 MolecularWeight: 475.53626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1[N+](=O)[O-])OC(=O)C2=C3CC(CCC3=NC4=CC=CC=C42)C(C)(C)C

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1[N+](=O)[O-])OC(=O)C2=C3CC(CCC3=NC4=CC=CC=C42)C(C)(C)C

InChI

InChI=1S/C27H29N3O5/c1-16(25(31)29-22-11-7-8-12-23(22)30(33)34)35-26(32)24-18-9-5-6-10-20(18)28-21-14-13-17(15-19(21)24)27(2,3)4/h5-12,16-17H,13-15H2,1-4H3,(H,29,31)