(phenylmethyl) N-[(3S)-1-nitro-3-phenylmethoxy-butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(3S)-1-nitro-3-phenylmethoxy-butan-2-yl]carbamate Openeye Name: benzyl N-[(2S)-2-benzyloxy-1-(nitromethyl)propyl]carbamate CAS Name: N-[(3S)-1-nitro-3-phenylmethoxybutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(3S)-1-nitro-3-phenylmethoxybutan-2-yl]carbamate Traditional Name: N-[(2S)-2-benzoxy-1-(nitromethyl)propyl]carbamic acid benzyl ester Formula: C19H22N2O5 MolecularWeight: 358.38838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C[N+](=O)[O-])NC(=O)OCC1=CC=CC=C1)OCC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(C[N+](=O)[O-])NC(=O)OCC1=CC=CC=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C19H22N2O5/c1-15(25-13-16-8-4-2-5-9-16)18(12-21(23)24)20-19(22)26-14-17-10-6-3-7-11-17/h2-11,15,18H,12-14H2,1H3,(H,20,22)/t15-,18?/m0/s1