(6S)-3-ethyl-6-[[(2-nitrophenyl)methyl-(phenylmethyl)amino]methyl]-1,3-oxazinan-2-one

Systemtic Name: (6S)-3-ethyl-6-[[(2-nitrophenyl)methyl-(phenylmethyl)amino]methyl]-1,3-oxazinan-2-one Openeye Name: (6S)-6-[[benzyl-[(2-nitrophenyl)methyl]amino]methyl]-3-ethyl-1,3-oxazinan-2-one CAS Name: (6S)-3-ethyl-6-[[(2-nitrophenyl)methyl-(phenylmethyl)amino]methyl]-1,3-oxazinan-2-one IUPAC Name: (6S)-6-[[benzyl-[(2-nitrophenyl)methyl]amino]methyl]-3-ethyl-1,3-oxazinan-2-one Traditional Name: (6S)-6-[[benzyl-(2-nitrobenzyl)amino]methyl]-3-ethyl-1,3-oxazinan-2-one Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(OC1=O)CN(CC2=CC=CC=C2)CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCN1CC[C@H](OC1=O)CN(CC2=CC=CC=C2)CC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O4/c1-2-23-13-12-19(28-21(23)25)16-22(14-17-8-4-3-5-9-17)15-18-10-6-7-11-20(18)24(26)27/h3-11,19H,2,12-16H2,1H3/t19-/m0/s1