N-[2-(cyclohexen-1-yl)ethyl]-1-[(2,5-dimethoxyphenyl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-1-[(2,5-dimethoxyphenyl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: N-[2-(cyclohexen-1-yl)ethyl]-1-[(2,5-dimethoxyphenyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N-[2-(1-cyclohexenyl)ethyl]-1-[(2,5-dimethoxyphenyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-1-[(2,5-dimethoxyphenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-[2-(cyclohexen-1-yl)ethyl]-1-(2,5-dimethoxybenzyl)piperidin-1-ium-4-carboxamide Formula: C23H35N2O3+ MolecularWeight: 387.5356

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C[NH+]2CCC(CC2)C(=O)NCCC3=CCCCC3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C[NH+]2CCC(CC2)C(=O)NCCC3=CCCCC3

InChI

InChI=1S/C23H34N2O3/c1-27-21-8-9-22(28-2)20(16-21)17-25-14-11-19(12-15-25)23(26)24-13-10-18-6-4-3-5-7-18/h6,8-9,16,19H,3-5,7,10-15,17H2,1-2H3,(H,24,26)/p+1