N-(2,6-diethylphenyl)-4-(piperidin-1-ium-1-ylmethyl)benzamide

Systemtic Name: N-(2,6-diethylphenyl)-4-(piperidin-1-ium-1-ylmethyl)benzamide Openeye Name: N-(2,6-diethylphenyl)-4-(piperidin-1-ium-1-ylmethyl)benzamide CAS Name: N-(2,6-diethylphenyl)-4-(1-piperidin-1-iumylmethyl)benzamide IUPAC Name: N-(2,6-diethylphenyl)-4-(piperidin-1-ium-1-ylmethyl)benzamide Traditional Name: N-(2,6-diethylphenyl)-4-(piperidin-1-ium-1-ylmethyl)benzamide Formula: C23H31N2O+ MolecularWeight: 351.50504

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)C2=CC=C(C=C2)C[NH+]3CCCCC3

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)C2=CC=C(C=C2)C[NH+]3CCCCC3

InChI

InChI=1S/C23H30N2O/c1-3-19-9-8-10-20(4-2)22(19)24-23(26)21-13-11-18(12-14-21)17-25-15-6-5-7-16-25/h8-14H,3-7,15-17H2,1-2H3,(H,24,26)/p+1