[(3S)-3-azanyl-4-oxidanylidene-4-phenylmethoxy-butyl]-methylimino-oxidanidyl-azanium

Systemtic Name: [(3S)-3-azanyl-4-oxidanylidene-4-phenylmethoxy-butyl]-methylimino-oxidanidyl-azanium Openeye Name: [(3S)-3-amino-4-benzyloxy-4-oxo-butyl]-methylimino-oxido-ammonium CAS Name: [(3S)-3-amino-4-oxo-4-phenylmethoxybutyl]-methylimino-oxidoammonium IUPAC Name: [(3S)-3-amino-4-oxo-4-phenylmethoxybutyl]-methylimino-oxidoazanium Traditional Name: [(3S)-3-amino-4-benzoxy-4-keto-butyl]-methylimino-oxido-ammonium Formula: C12H17N3O3 MolecularWeight: 251.28168

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Descriptors Computed from Structure

Canonical SMILES:

CN=[N+](CCC(C(=O)OCC1=CC=CC=C1)N)[O-]

Isomeric SMILES

CN=[N+](CC[C@@H](C(=O)OCC1=CC=CC=C1)N)[O-]

InChI

InChI=1S/C12H17N3O3/c1-14-15(17)8-7-11(13)12(16)18-9-10-5-3-2-4-6-10/h2-6,11H,7-9,13H2,1H3/t11-/m0/s1