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

Systemtic Name: N-(2,4-dimethoxyphenyl)-3-[1-[(3-ethoxyphenyl)methyl]piperidin-1-ium-4-yl]propanamide Openeye Name: N-(2,4-dimethoxyphenyl)-3-[1-[(3-ethoxyphenyl)methyl]piperidin-1-ium-4-yl]propanamide CAS Name: N-(2,4-dimethoxyphenyl)-3-[1-[(3-ethoxyphenyl)methyl]-4-piperidin-1-iumyl]propanamide IUPAC Name: N-(2,4-dimethoxyphenyl)-3-[1-[(3-ethoxyphenyl)methyl]piperidin-1-ium-4-yl]propanamide Traditional Name: N-(2,4-dimethoxyphenyl)-3-[1-(3-ethoxybenzyl)piperidin-1-ium-4-yl]propionamide Formula: C25H35N2O4+ MolecularWeight: 427.5564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C[NH+]2CCC(CC2)CCC(=O)NC3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CCOC1=CC=CC(=C1)C[NH+]2CCC(CC2)CCC(=O)NC3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C25H34N2O4/c1-4-31-22-7-5-6-20(16-22)18-27-14-12-19(13-15-27)8-11-25(28)26-23-10-9-21(29-2)17-24(23)30-3/h5-7,9-10,16-17,19H,4,8,11-15,18H2,1-3H3,(H,26,28)/p+1