N-(3-methylphenyl)-4-(piperidin-1-ium-1-ylmethyl)benzamide

Systemtic Name: N-(3-methylphenyl)-4-(piperidin-1-ium-1-ylmethyl)benzamide Openeye Name: N-(m-tolyl)-4-(piperidin-1-ium-1-ylmethyl)benzamide CAS Name: N-(3-methylphenyl)-4-(1-piperidin-1-iumylmethyl)benzamide IUPAC Name: N-(3-methylphenyl)-4-(piperidin-1-ium-1-ylmethyl)benzamide Traditional Name: N-(m-tolyl)-4-(piperidin-1-ium-1-ylmethyl)benzamide Formula: C20H25N2O+ MolecularWeight: 309.4253

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)C[NH+]3CCCCC3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)C[NH+]3CCCCC3

InChI

InChI=1S/C20H24N2O/c1-16-6-5-7-19(14-16)21-20(23)18-10-8-17(9-11-18)15-22-12-3-2-4-13-22/h5-11,14H,2-4,12-13,15H2,1H3,(H,21,23)/p+1