1-(4-ethylphenyl)-N,N-dimethyl-N'-(3-methyl-5-nitro-imidazol-4-yl)ethane-1,2-diamine

Systemtic Name: 1-(4-ethylphenyl)-N,N-dimethyl-N'-(3-methyl-5-nitro-imidazol-4-yl)ethane-1,2-diamine Openeye Name: 1-(4-ethylphenyl)-N,N-dimethyl-N'-(3-methyl-5-nitro-imidazol-4-yl)ethane-1,2-diamine CAS Name: 1-(4-ethylphenyl)-N,N-dimethyl-N'-(3-methyl-5-nitro-4-imidazolyl)ethane-1,2-diamine IUPAC Name: 1-(4-ethylphenyl)-N,N-dimethyl-N'-(3-methyl-5-nitroimidazol-4-yl)ethane-1,2-diamine Traditional Name: [1-(4-ethylphenyl)-2-[(3-methyl-5-nitro-imidazol-4-yl)amino]ethyl]-dimethyl-amine Formula: C16H23N5O2 MolecularWeight: 317.38612

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CNC2=C(N=CN2C)[N+](=O)[O-])N(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(CNC2=C(N=CN2C)[N+](=O)[O-])N(C)C

InChI

InChI=1S/C16H23N5O2/c1-5-12-6-8-13(9-7-12)14(19(2)3)10-17-15-16(21(22)23)18-11-20(15)4/h6-9,11,14,17H,5,10H2,1-4H3