(phenylmethyl) N-[(2S)-6-nitro-1-oxidanylidene-1-pyrrolidin-1-yl-hexan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-6-nitro-1-oxidanylidene-1-pyrrolidin-1-yl-hexan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-5-nitro-1-(pyrrolidine-1-carbonyl)pentyl]carbamate CAS Name: N-[(2S)-6-nitro-1-oxo-1-(1-pyrrolidinyl)hexan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-6-nitro-1-oxo-1-pyrrolidin-1-ylhexan-2-yl]carbamate Traditional Name: N-[(1S)-5-nitro-1-(pyrrolidine-1-carbonyl)pentyl]carbamic acid benzyl ester Formula: C18H25N3O5 MolecularWeight: 363.4082

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C(CCCC[N+](=O)[O-])NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1CCN(C1)C(=O)[C@H](CCCC[N+](=O)[O-])NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H25N3O5/c22-17(20-11-6-7-12-20)16(10-4-5-13-21(24)25)19-18(23)26-14-15-8-2-1-3-9-15/h1-3,8-9,16H,4-7,10-14H2,(H,19,23)/t16-/m0/s1