N-(3-imidazol-1-ylpropyl)-4-methyl-2-nitro-aniline

Systemtic Name: N-(3-imidazol-1-ylpropyl)-4-methyl-2-nitro-aniline Openeye Name: N-(3-imidazol-1-ylpropyl)-4-methyl-2-nitro-aniline CAS Name: N-[3-(1-imidazolyl)propyl]-4-methyl-2-nitroaniline IUPAC Name: N-(3-imidazol-1-ylpropyl)-4-methyl-2-nitroaniline Traditional Name: 3-imidazol-1-ylpropyl-(4-methyl-2-nitro-phenyl)amine Formula: C13H16N4O2 MolecularWeight: 260.29174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NCCCN2C=CN=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NCCCN2C=CN=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H16N4O2/c1-11-3-4-12(13(9-11)17(18)19)15-5-2-7-16-8-6-14-10-16/h3-4,6,8-10,15H,2,5,7H2,1H3