tert-butyl N-cyclohexyl-N-(5-nitro-6-phenylazanyl-pyridin-2-yl)carbamate

Systemtic Name: tert-butyl N-cyclohexyl-N-(5-nitro-6-phenylazanyl-pyridin-2-yl)carbamate Openeye Name: tert-butyl N-(6-anilino-5-nitro-2-pyridyl)-N-cyclohexyl-carbamate CAS Name: N-(6-anilino-5-nitro-2-pyridinyl)-N-cyclohexylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(6-anilino-5-nitropyridin-2-yl)-N-cyclohexylcarbamate Traditional Name: N-(6-anilino-5-nitro-2-pyridyl)-N-cyclohexyl-carbamic acid tert-butyl ester Formula: C22H28N4O4 MolecularWeight: 412.48212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C1CCCCC1)C2=NC(=C(C=C2)[N+](=O)[O-])NC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N(C1CCCCC1)C2=NC(=C(C=C2)[N+](=O)[O-])NC3=CC=CC=C3

InChI

InChI=1S/C22H28N4O4/c1-22(2,3)30-21(27)25(17-12-8-5-9-13-17)19-15-14-18(26(28)29)20(24-19)23-16-10-6-4-7-11-16/h4,6-7,10-11,14-15,17H,5,8-9,12-13H2,1-3H3,(H,23,24)