N-(3,5-dimethylphenyl)-4-(piperidin-1-ium-1-ylmethyl)benzamide

Systemtic Name: N-(3,5-dimethylphenyl)-4-(piperidin-1-ium-1-ylmethyl)benzamide Openeye Name: N-(3,5-dimethylphenyl)-4-(piperidin-1-ium-1-ylmethyl)benzamide CAS Name: N-(3,5-dimethylphenyl)-4-(1-piperidin-1-iumylmethyl)benzamide IUPAC Name: N-(3,5-dimethylphenyl)-4-(piperidin-1-ium-1-ylmethyl)benzamide Traditional Name: N-(3,5-dimethylphenyl)-4-(piperidin-1-ium-1-ylmethyl)benzamide Formula: C21H27N2O+ MolecularWeight: 323.45188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O/c1-16-12-17(2)14-20(13-16)22-21(24)19-8-6-18(7-9-19)15-23-10-4-3-5-11-23/h6-9,12-14H,3-5,10-11,15H2,1-2H3,(H,22,24)/p+1