3-[1-[[5-(methoxymethyl)furan-2-yl]methyl]piperidin-1-ium-4-yl]-N-(3-methoxyphenyl)propanamide

Systemtic Name: 3-[1-[[5-(methoxymethyl)furan-2-yl]methyl]piperidin-1-ium-4-yl]-N-(3-methoxyphenyl)propanamide Openeye Name: 3-[1-[[5-(methoxymethyl)-2-furyl]methyl]piperidin-1-ium-4-yl]-N-(3-methoxyphenyl)propanamide CAS Name: 3-[1-[[5-(methoxymethyl)-2-furanyl]methyl]-4-piperidin-1-iumyl]-N-(3-methoxyphenyl)propanamide IUPAC Name: 3-[1-[[5-(methoxymethyl)furan-2-yl]methyl]piperidin-1-ium-4-yl]-N-(3-methoxyphenyl)propanamide Traditional Name: 3-[1-[[5-(methoxymethyl)-2-furyl]methyl]piperidin-1-ium-4-yl]-N-(3-methoxyphenyl)propionamide Formula: C22H31N2O4+ MolecularWeight: 387.49254

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=CC=C(O1)C[NH+]2CCC(CC2)CCC(=O)NC3=CC(=CC=C3)OC

Isomeric SMILES

COCC1=CC=C(O1)C[NH+]2CCC(CC2)CCC(=O)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C22H30N2O4/c1-26-16-21-8-7-20(28-21)15-24-12-10-17(11-13-24)6-9-22(25)23-18-4-3-5-19(14-18)27-2/h3-5,7-8,14,17H,6,9-13,15-16H2,1-2H3,(H,23,25)/p+1