N-[2-(cyclohexen-1-yl)ethyl]-1-[(4-phenylmethoxyphenyl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-1-[(4-phenylmethoxyphenyl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(4-benzyloxyphenyl)methyl]-N-[2-(cyclohexen-1-yl)ethyl]piperidin-1-ium-4-carboxamide CAS Name: N-[2-(1-cyclohexenyl)ethyl]-1-[(4-phenylmethoxyphenyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-1-[(4-phenylmethoxyphenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-(4-benzoxybenzyl)-N-[2-(cyclohexen-1-yl)ethyl]piperidin-1-ium-4-carboxamide Formula: C28H37N2O2+ MolecularWeight: 433.60558

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC(=O)C2CC[NH+](CC2)CC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1CCC(=CC1)CCNC(=O)C2CC[NH+](CC2)CC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C28H36N2O2/c31-28(29-18-15-23-7-3-1-4-8-23)26-16-19-30(20-17-26)21-24-11-13-27(14-12-24)32-22-25-9-5-2-6-10-25/h2,5-7,9-14,26H,1,3-4,8,15-22H2,(H,29,31)/p+1