(phenylmethyl) N-[(2R)-4-nitro-3-oxidanylidene-1-phenyl-butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2R)-4-nitro-3-oxidanylidene-1-phenyl-butan-2-yl]carbamate Openeye Name: benzyl N-[(1R)-1-benzyl-3-nitro-2-oxo-propyl]carbamate CAS Name: N-[(2R)-4-nitro-3-oxo-1-phenylbutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2R)-4-nitro-3-oxo-1-phenylbutan-2-yl]carbamate Traditional Name: N-[(1R)-1-benzyl-2-keto-3-nitro-propyl]carbamic acid benzyl ester Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O5/c21-17(12-20(23)24)16(11-14-7-3-1-4-8-14)19-18(22)25-13-15-9-5-2-6-10-15/h1-10,16H,11-13H2,(H,19,22)/t16-/m1/s1