2-(2-methyl-5-nitro-imidazol-1-yl)-N,N-bis(phenylmethyl)ethanamine dihydrochloride

Systemtic Name: 2-(2-methyl-5-nitro-imidazol-1-yl)-N,N-bis(phenylmethyl)ethanamine dihydrochloride Openeye Name: N,N-dibenzyl-2-(2-methyl-5-nitro-imidazol-1-yl)ethanamine dihydrochloride CAS Name: 2-(2-methyl-5-nitro-1-imidazolyl)-N,N-bis(phenylmethyl)ethanamine dihydrochloride IUPAC Name: N,N-dibenzyl-2-(2-methyl-5-nitroimidazol-1-yl)ethanamine dihydrochloride Traditional Name: dibenzyl-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]amine dihydrochloride Formula: C20H24Cl2N4O2 MolecularWeight: 423.33616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCN(CC2=CC=CC=C2)CC3=CC=CC=C3)[N+](=O)[O-].Cl.Cl

Isomeric SMILES

CC1=NC=C(N1CCN(CC2=CC=CC=C2)CC3=CC=CC=C3)[N+](=O)[O-].Cl.Cl

InChI

InChI=1S/C20H22N4O2.2ClH/c1-17-21-14-20(24(25)26)23(17)13-12-22(15-18-8-4-2-5-9-18)16-19-10-6-3-7-11-19;;/h2-11,14H,12-13,15-16H2,1H3;2*1H