[1-[(2,3-dimethoxyphenyl)methyl]-4-(3-phenylpropyl)piperidin-1-ium-4-yl]methanol

Systemtic Name: [1-[(2,3-dimethoxyphenyl)methyl]-4-(3-phenylpropyl)piperidin-1-ium-4-yl]methanol Openeye Name: [1-[(2,3-dimethoxyphenyl)methyl]-4-(3-phenylpropyl)piperidin-1-ium-4-yl]methanol CAS Name: [1-[(2,3-dimethoxyphenyl)methyl]-4-(3-phenylpropyl)-4-piperidin-1-iumyl]methanol IUPAC Name: [1-[(2,3-dimethoxyphenyl)methyl]-4-(3-phenylpropyl)piperidin-1-ium-4-yl]methanol Traditional Name: [1-o-veratryl-4-(3-phenylpropyl)piperidin-1-ium-4-yl]methanol Formula: C24H34NO3+ MolecularWeight: 384.53166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C[NH+]2CCC(CC2)(CCCC3=CC=CC=C3)CO

Isomeric SMILES

COC1=CC=CC(=C1OC)C[NH+]2CCC(CC2)(CCCC3=CC=CC=C3)CO

InChI

InChI=1S/C24H33NO3/c1-27-22-12-6-11-21(23(22)28-2)18-25-16-14-24(19-26,15-17-25)13-7-10-20-8-4-3-5-9-20/h3-6,8-9,11-12,26H,7,10,13-19H2,1-2H3/p+1