N-(4,5-dimethyl-2-nitro-phenyl)-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: N-(4,5-dimethyl-2-nitro-phenyl)-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-(4,5-dimethyl-2-nitro-phenyl)-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-(4,5-dimethyl-2-nitrophenyl)-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-(4,5-dimethyl-2-nitrophenyl)-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-(4,5-dimethyl-2-nitro-phenyl)-2-piperidin-1-ium-1-yl-acetamide Formula: C15H22N3O3+ MolecularWeight: 292.35348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)[N+](=O)[O-])NC(=O)C[NH+]2CCCCC2

Isomeric SMILES

CC1=CC(=C(C=C1C)[N+](=O)[O-])NC(=O)C[NH+]2CCCCC2

InChI

InChI=1S/C15H21N3O3/c1-11-8-13(14(18(20)21)9-12(11)2)16-15(19)10-17-6-4-3-5-7-17/h8-9H,3-7,10H2,1-2H3,(H,16,19)/p+1