N-[6-(dimethylamino)pyridin-3-yl]-4-(piperidin-1-ium-1-ylmethyl)benzamide

Systemtic Name: N-[6-(dimethylamino)pyridin-3-yl]-4-(piperidin-1-ium-1-ylmethyl)benzamide Openeye Name: N-[6-(dimethylamino)-3-pyridyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide CAS Name: N-[6-(dimethylamino)-3-pyridinyl]-4-(1-piperidin-1-iumylmethyl)benzamide IUPAC Name: N-[6-(dimethylamino)pyridin-3-yl]-4-(piperidin-1-ium-1-ylmethyl)benzamide Traditional Name: N-[6-(dimethylamino)-3-pyridyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide Formula: C20H27N4O+ MolecularWeight: 339.45458

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=C(C=C1)NC(=O)C2=CC=C(C=C2)C[NH+]3CCCCC3

Isomeric SMILES

CN(C)C1=NC=C(C=C1)NC(=O)C2=CC=C(C=C2)C[NH+]3CCCCC3

InChI

InChI=1S/C20H26N4O/c1-23(2)19-11-10-18(14-21-19)22-20(25)17-8-6-16(7-9-17)15-24-12-4-3-5-13-24/h6-11,14H,3-5,12-13,15H2,1-2H3,(H,22,25)/p+1