Etonitazepyne | |
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Molecular structure via molpic based on CDK |
Conformer [] | |
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Conformer structure via JSmol |
Physical properties [] | |
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Molecular mass | 394.5 g/mol [1] |
Predicted LogP | 4 [1] |
Structural Identifiers [] | |
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Molecular formula | C22H26N4O3 [1] |
IUPAC name | 2-[(4-ethoxyphenyl)methyl]-5-nitro-1-(2-pyrrolidin-1-ylethyl)benzimidazole [1] |
SMILES | CCOC1=CC=C(C=C1)CC2=NC3=C(N2CCN4CCCC4)C=CC(=C3)[N+](=O)[O-] [1] |
InChI | InChI=1S/C22H26N4O3/c1-2-29-19-8-5-17(6-9-19)15-22-23-20-16-18(26(27)28)7-10-21(20)25(22)14-13-24-11-3-4-12-24/h5-10,16H,2-4,11-15H2,1H3 [1] |
InChIKey | LQZWZCJCEPUKCJ-UHFFFAOYSA-N [1] |
Etonitazepyne
Etonitazepyne (also known as N-PYRROLIDINO ETONITAZENE, 8HY67JQ9ZH, 2785346-75-8, 2-(4-ETHOXYBENZYL)-5-NITRO-1-(2-(PYRROLIDIN-1-YL)ETHYL)-1H-BENZO(D)IMIDAZOLE, C22701 or 2-(4-ethoxybenzyl)-5-nitro-1-(2-(pyrrolidin-1-yl)ethyl)-1H-benzimidazole)
Chemistry
Stereochemistry []
Etonitazepyne is a achiral mixture