[2-(5-nitronaphthalen-1-yl)-2-oxidanylidene-ethyl] 2-(2-methylbutan-2-yl)-1,2,3,4-tetrahydroacridine-9-carboxylate

Systemtic Name: [2-(5-nitronaphthalen-1-yl)-2-oxidanylidene-ethyl] 2-(2-methylbutan-2-yl)-1,2,3,4-tetrahydroacridine-9-carboxylate Openeye Name: [2-(5-nitro-1-naphthyl)-2-oxo-ethyl] 2-(1,1-dimethylpropyl)-1,2,3,4-tetrahydroacridine-9-carboxylate CAS Name: 2-(2-methylbutan-2-yl)-1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-(5-nitro-1-naphthalenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-nitronaphthalen-1-yl)-2-oxoethyl] 2-(2-methylbutan-2-yl)-1,2,3,4-tetrahydroacridine-9-carboxylate Traditional Name: 2-tert-amyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-keto-2-(5-nitro-1-naphthyl)ethyl] ester Formula: C31H30N2O5 MolecularWeight: 510.5803

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)OCC(=O)C4=CC=CC5=C4C=CC=C5[N+](=O)[O-]

Isomeric SMILES

CCC(C)(C)C1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)OCC(=O)C4=CC=CC5=C4C=CC=C5[N+](=O)[O-]

InChI

InChI=1S/C31H30N2O5/c1-4-31(2,3)19-15-16-26-24(17-19)29(23-9-5-6-13-25(23)32-26)30(35)38-18-28(34)22-12-7-11-21-20(22)10-8-14-27(21)33(36)37/h5-14,19H,4,15-18H2,1-3H3