(phenylmethyl) 2-(6-nitrohexanoyl)pyrazolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-(6-nitrohexanoyl)pyrazolidine-1-carboxylate Openeye Name: benzyl 2-(6-nitrohexanoyl)pyrazolidine-1-carboxylate CAS Name: 2-(6-nitro-1-oxohexyl)-1-pyrazolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(6-nitrohexanoyl)pyrazolidine-1-carboxylate Traditional Name: 2-(6-nitrohexanoyl)pyrazolidine-1-carboxylic acid benzyl ester Formula: C17H23N3O5 MolecularWeight: 349.38162

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)CCCCC[N+](=O)[O-]

Isomeric SMILES

C1CN(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)CCCCC[N+](=O)[O-]

InChI

InChI=1S/C17H23N3O5/c21-16(10-5-2-6-13-20(23)24)18-11-7-12-19(18)17(22)25-14-15-8-3-1-4-9-15/h1,3-4,8-9H,2,5-7,10-14H2