N-(2,4-dimethoxyphenyl)-3-[1-[(4-ethylphenyl)methyl]piperidin-1-ium-4-yl]propanamide

Systemtic Name: N-(2,4-dimethoxyphenyl)-3-[1-[(4-ethylphenyl)methyl]piperidin-1-ium-4-yl]propanamide Openeye Name: N-(2,4-dimethoxyphenyl)-3-[1-[(4-ethylphenyl)methyl]piperidin-1-ium-4-yl]propanamide CAS Name: N-(2,4-dimethoxyphenyl)-3-[1-[(4-ethylphenyl)methyl]-4-piperidin-1-iumyl]propanamide IUPAC Name: N-(2,4-dimethoxyphenyl)-3-[1-[(4-ethylphenyl)methyl]piperidin-1-ium-4-yl]propanamide Traditional Name: N-(2,4-dimethoxyphenyl)-3-[1-(4-ethylbenzyl)piperidin-1-ium-4-yl]propionamide Formula: C25H35N2O3+ MolecularWeight: 411.557

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+]2CCC(CC2)CCC(=O)NC3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+]2CCC(CC2)CCC(=O)NC3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C25H34N2O3/c1-4-19-5-7-21(8-6-19)18-27-15-13-20(14-16-27)9-12-25(28)26-23-11-10-22(29-2)17-24(23)30-3/h5-8,10-11,17,20H,4,9,12-16,18H2,1-3H3,(H,26,28)/p+1