[2-[(5-methoxy-2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] (2R)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylate

Systemtic Name: [2-[(5-methoxy-2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] (2R)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylate Openeye Name: [2-(5-methoxy-2-methyl-4-nitro-anilino)-2-oxo-ethyl] (2R)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylate CAS Name: (2R)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-(5-methoxy-2-methyl-4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(5-methoxy-2-methyl-4-nitroanilino)-2-oxoethyl] (2R)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylate Traditional Name: (2R)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-keto-2-(5-methoxy-2-methyl-4-nitro-anilino)ethyl] ester Formula: C28H31N3O6 MolecularWeight: 505.56224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=O)COC(=O)C2=C3CC(CCC3=NC4=CC=CC=C42)C(C)(C)C)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1NC(=O)COC(=O)C2=C3C[C@@H](CCC3=NC4=CC=CC=C42)C(C)(C)C)OC)[N+](=O)[O-]

InChI

InChI=1S/C28H31N3O6/c1-16-12-23(31(34)35)24(36-5)14-22(16)30-25(32)15-37-27(33)26-18-8-6-7-9-20(18)29-21-11-10-17(13-19(21)26)28(2,3)4/h6-9,12,14,17H,10-11,13,15H2,1-5H3,(H,30,32)/t17-/m1/s1