3-acetamido-N-[2-(4-methoxyphenyl)ethyl]-N-[(1-methylpiperidin-1-ium-4-yl)methyl]propanamide

Systemtic Name: 3-acetamido-N-[2-(4-methoxyphenyl)ethyl]-N-[(1-methylpiperidin-1-ium-4-yl)methyl]propanamide Openeye Name: 3-acetamido-N-[2-(4-methoxyphenyl)ethyl]-N-[(1-methylpiperidin-1-ium-4-yl)methyl]propanamide CAS Name: 3-acetamido-N-[2-(4-methoxyphenyl)ethyl]-N-[(1-methyl-4-piperidin-1-iumyl)methyl]propanamide IUPAC Name: 3-acetamido-N-[2-(4-methoxyphenyl)ethyl]-N-[(1-methylpiperidin-1-ium-4-yl)methyl]propanamide Traditional Name: 3-acetamido-N-[2-(4-methoxyphenyl)ethyl]-N-[(1-methylpiperidin-1-ium-4-yl)methyl]propionamide Formula: C21H34N3O3+ MolecularWeight: 376.51296

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC(=O)N(CCC1=CC=C(C=C1)OC)CC2CC[NH+](CC2)C

Isomeric SMILES

CC(=O)NCCC(=O)N(CCC1=CC=C(C=C1)OC)CC2CC[NH+](CC2)C

InChI

InChI=1S/C21H33N3O3/c1-17(25)22-12-8-21(26)24(16-19-9-13-23(2)14-10-19)15-11-18-4-6-20(27-3)7-5-18/h4-7,19H,8-16H2,1-3H3,(H,22,25)/p+1