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4-[3-(4-methylpiperidin-1-ium-1-yl)propylamino]-3-nitro-benzamide

4-[3-(4-methylpiperidin-1-ium-1-yl)propylamino]-3-nitro-benzamide

Systemtic Name:4-[3-(4-methylpiperidin-1-ium-1-yl)propylamino]-3-nitro-benzamide
Openeye Name:4-[3-(4-methylpiperidin-1-ium-1-yl)propylamino]-3-nitro-benzamide
CAS Name:4-[3-(4-methyl-1-piperidin-1-iumyl)propylamino]-3-nitrobenzamide
IUPAC Name:4-[3-(4-methylpiperidin-1-ium-1-yl)propylamino]-3-nitrobenzamide
Traditional Name:4-[3-(4-methylpiperidin-1-ium-1-yl)propylamino]-3-nitro-benzamide
Formula: C16H25N4O3+
MolecularWeight: 321.3947
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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCCNC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]


Isomeric SMILES

CC1CC[NH+](CC1)CCCNC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]


InChI

InChI=1S/C16H24N4O3/c1-12-5-9-19(10-6-12)8-2-7-18-14-4-3-13(16(17)21)11-15(14)20(22)23/h3-4,11-12,18H,2,5-10H2,1H3,(H2,17,21)/p+1


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