(phenylmethyl) N-[(2S)-2-(4-nitrophenyl)-2-oxidanyl-ethyl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-2-(4-nitrophenyl)-2-oxidanyl-ethyl]carbamate Openeye Name: benzyl N-[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]carbamate CAS Name: N-[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]carbamate Traditional Name: N-[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]carbamic acid benzyl ester Formula: C16H16N2O5 MolecularWeight: 316.30864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCC(C2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

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

InChI

InChI=1S/C16H16N2O5/c19-15(13-6-8-14(9-7-13)18(21)22)10-17-16(20)23-11-12-4-2-1-3-5-12/h1-9,15,19H,10-11H2,(H,17,20)/t15-/m1/s1