[2-[(3-ethanoylphenyl)amino]-2-oxidanylidene-ethyl] (2R)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylate

Systemtic Name: [2-[(3-ethanoylphenyl)amino]-2-oxidanylidene-ethyl] (2R)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylate Openeye Name: [2-(3-acetylanilino)-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-(3-acetylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-acetylanilino)-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-(3-acetylanilino)-2-keto-ethyl] ester Formula: C28H30N2O4 MolecularWeight: 458.5488

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)COC(=O)C2=C3CC(CCC3=NC4=CC=CC=C42)C(C)(C)C

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)COC(=O)C2=C3C[C@@H](CCC3=NC4=CC=CC=C42)C(C)(C)C

InChI

InChI=1S/C28H30N2O4/c1-17(31)18-8-7-9-20(14-18)29-25(32)16-34-27(33)26-21-10-5-6-11-23(21)30-24-13-12-19(15-22(24)26)28(2,3)4/h5-11,14,19H,12-13,15-16H2,1-4H3,(H,29,32)/t19-/m1/s1