tert-butyl 4-[(3-nitrophenyl)-(3-phenylpropyl)amino]-2,4-bis(oxidanylidene)butanoate

Systemtic Name: tert-butyl 4-[(3-nitrophenyl)-(3-phenylpropyl)amino]-2,4-bis(oxidanylidene)butanoate Openeye Name: tert-butyl 4-[3-nitro-N-(3-phenylpropyl)anilino]-2,4-dioxo-butanoate CAS Name: 4-[3-nitro-N-(3-phenylpropyl)anilino]-2,4-dioxobutanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-nitro-N-(3-phenylpropyl)anilino]-2,4-dioxobutanoate Traditional Name: 2,4-diketo-4-[3-nitro-N-(3-phenylpropyl)anilino]butyric acid tert-butyl ester Formula: C23H26N2O6 MolecularWeight: 426.46234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(=O)CC(=O)N(CCCC1=CC=CC=C1)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)C(=O)CC(=O)N(CCCC1=CC=CC=C1)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C23H26N2O6/c1-23(2,3)31-22(28)20(26)16-21(27)24(14-8-11-17-9-5-4-6-10-17)18-12-7-13-19(15-18)25(29)30/h4-7,9-10,12-13,15H,8,11,14,16H2,1-3H3