5-imidazol-1-yl-2-nitro-N-propyl-aniline

Systemtic Name: 5-imidazol-1-yl-2-nitro-N-propyl-aniline Openeye Name: 5-imidazol-1-yl-2-nitro-N-propyl-aniline CAS Name: 5-(1-imidazolyl)-2-nitro-N-propylaniline IUPAC Name: 5-imidazol-1-yl-2-nitro-N-propylaniline Traditional Name: (5-imidazol-1-yl-2-nitro-phenyl)-propyl-amine Formula: C12H14N4O2 MolecularWeight: 246.26516

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C=CC(=C1)N2C=CN=C2)[N+](=O)[O-]

Isomeric SMILES

CCCNC1=C(C=CC(=C1)N2C=CN=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H14N4O2/c1-2-5-14-11-8-10(15-7-6-13-9-15)3-4-12(11)16(17)18/h3-4,6-9,14H,2,5H2,1H3