4-nitro-3-phenyl-butane-1,2-diamine

Systemtic Name: 4-nitro-3-phenyl-butane-1,2-diamine Openeye Name: 4-nitro-3-phenyl-butane-1,2-diamine CAS Name: 4-nitro-3-phenylbutane-1,2-diamine IUPAC Name: 4-nitro-3-phenylbutane-1,2-diamine Traditional Name: [1-(aminomethyl)-3-nitro-2-phenyl-propyl]amine Formula: C10H15N3O2 MolecularWeight: 209.245

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H15N3O2/c11-6-10(12)9(7-13(14)15)8-4-2-1-3-5-8/h1-5,9-10H,6-7,11-12H2