1-[(4-ethylphenyl)methyl]-N-phenethyl-N-(phenylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(4-ethylphenyl)methyl]-N-phenethyl-N-(phenylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: N-benzyl-1-[(4-ethylphenyl)methyl]-N-phenethyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[(4-ethylphenyl)methyl]-N-phenethyl-N-(phenylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-benzyl-1-[(4-ethylphenyl)methyl]-N-phenethylpiperidin-1-ium-4-carboxamide Traditional Name: N-benzyl-1-(4-ethylbenzyl)-N-phenethyl-piperidin-1-ium-4-carboxamide Formula: C30H37N2O+ MolecularWeight: 441.62758

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+]2CCC(CC2)C(=O)N(CCC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+]2CCC(CC2)C(=O)N(CCC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C30H36N2O/c1-2-25-13-15-28(16-14-25)23-31-20-18-29(19-21-31)30(33)32(24-27-11-7-4-8-12-27)22-17-26-9-5-3-6-10-26/h3-16,29H,2,17-24H2,1H3/p+1