2-methyl-N-[3-(2-nitroimidazol-2-yl)propyl]quinolin-4-amine

Systemtic Name: 2-methyl-N-[3-(2-nitroimidazol-2-yl)propyl]quinolin-4-amine Openeye Name: 2-methyl-N-[3-(2-nitroimidazol-2-yl)propyl]quinolin-4-amine CAS Name: 2-methyl-N-[3-(2-nitro-2-imidazolyl)propyl]-4-quinolinamine IUPAC Name: 2-methyl-N-[3-(2-nitroimidazol-2-yl)propyl]quinolin-4-amine Traditional Name: (2-methyl-4-quinolyl)-[3-(2-nitroimidazol-2-yl)propyl]amine Formula: C16H17N5O2 MolecularWeight: 311.33848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NCCCC3(N=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NCCCC3(N=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C16H17N5O2/c1-12-11-15(13-5-2-3-6-14(13)20-12)17-8-4-7-16(21(22)23)18-9-10-19-16/h2-3,5-6,9-11H,4,7-8H2,1H3,(H,17,20)