(2S)-3-(4-nitrophenyl)propane-1,2-diamine

Systemtic Name: (2S)-3-(4-nitrophenyl)propane-1,2-diamine Openeye Name: (2S)-3-(4-nitrophenyl)propane-1,2-diamine CAS Name: (2S)-3-(4-nitrophenyl)propane-1,2-diamine IUPAC Name: (2S)-3-(4-nitrophenyl)propane-1,2-diamine Traditional Name: [(1S)-1-(aminomethyl)-2-(4-nitrophenyl)ethyl]amine Formula: C9H13N3O2 MolecularWeight: 195.21842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(CN)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C[C@@H](CN)N)[N+](=O)[O-]

InChI

InChI=1S/C9H13N3O2/c10-6-8(11)5-7-1-3-9(4-2-7)12(13)14/h1-4,8H,5-6,10-11H2/t8-/m0/s1