2-nitro-3-phenyl-propane-1,2-diamine

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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