3-[1-[(4-acetamidophenyl)methyl]piperidin-1-ium-4-yl]-N-(2-methoxyethyl)propanamide

Systemtic Name: 3-[1-[(4-acetamidophenyl)methyl]piperidin-1-ium-4-yl]-N-(2-methoxyethyl)propanamide Openeye Name: 3-[1-[(4-acetamidophenyl)methyl]piperidin-1-ium-4-yl]-N-(2-methoxyethyl)propanamide CAS Name: 3-[1-[(4-acetamidophenyl)methyl]-4-piperidin-1-iumyl]-N-(2-methoxyethyl)propanamide IUPAC Name: 3-[1-[(4-acetamidophenyl)methyl]piperidin-1-ium-4-yl]-N-(2-methoxyethyl)propanamide Traditional Name: 3-[1-(4-acetamidobenzyl)piperidin-1-ium-4-yl]-N-(2-methoxyethyl)propionamide Formula: C20H32N3O3+ MolecularWeight: 362.48638

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C[NH+]2CCC(CC2)CCC(=O)NCCOC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C[NH+]2CCC(CC2)CCC(=O)NCCOC

InChI

InChI=1S/C20H31N3O3/c1-16(24)22-19-6-3-18(4-7-19)15-23-12-9-17(10-13-23)5-8-20(25)21-11-14-26-2/h3-4,6-7,17H,5,8-15H2,1-2H3,(H,21,25)(H,22,24)/p+1