tert-butyl 3-aminocarbonyl-3-ethyl-2-(5-nitropyrazol-1-yl)azetidine-1-carboxylate

Systemtic Name: tert-butyl 3-aminocarbonyl-3-ethyl-2-(5-nitropyrazol-1-yl)azetidine-1-carboxylate Openeye Name: tert-butyl 3-carbamoyl-3-ethyl-2-(5-nitropyrazol-1-yl)azetidine-1-carboxylate CAS Name: 3-carbamoyl-3-ethyl-2-(5-nitro-1-pyrazolyl)-1-azetidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-carbamoyl-3-ethyl-2-(5-nitropyrazol-1-yl)azetidine-1-carboxylate Traditional Name: 3-carbamoyl-3-ethyl-2-(5-nitropyrazol-1-yl)azetidine-1-carboxylic acid tert-butyl ester Formula: C14H21N5O5 MolecularWeight: 339.34704

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CN(C1N2C(=CC=N2)[N+](=O)[O-])C(=O)OC(C)(C)C)C(=O)N

Isomeric SMILES

CCC1(CN(C1N2C(=CC=N2)[N+](=O)[O-])C(=O)OC(C)(C)C)C(=O)N

InChI

InChI=1S/C14H21N5O5/c1-5-14(10(15)20)8-17(12(21)24-13(2,3)4)11(14)18-9(19(22)23)6-7-16-18/h6-7,11H,5,8H2,1-4H3,(H2,15,20)