N-[(1-methylpiperidin-1-ium-4-yl)methyl]-3-(1,2-oxazolidin-2-yl)-N-phenethyl-propanamide

Systemtic Name: N-[(1-methylpiperidin-1-ium-4-yl)methyl]-3-(1,2-oxazolidin-2-yl)-N-phenethyl-propanamide Openeye Name: 3-isoxazolidin-2-yl-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethyl-propanamide CAS Name: 3-(2-isoxazolidinyl)-N-[(1-methyl-4-piperidin-1-iumyl)methyl]-N-phenethylpropanamide IUPAC Name: N-[(1-methylpiperidin-1-ium-4-yl)methyl]-3-(1,2-oxazolidin-2-yl)-N-phenethylpropanamide Traditional Name: 3-isoxazolidin-2-yl-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethyl-propionamide Formula: C21H34N3O2+ MolecularWeight: 360.51356

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)CN(CCC2=CC=CC=C2)C(=O)CCN3CCCO3

Isomeric SMILES

C[NH+]1CCC(CC1)CN(CCC2=CC=CC=C2)C(=O)CCN3CCCO3

InChI

InChI=1S/C21H33N3O2/c1-22-13-8-20(9-14-22)18-23(15-10-19-6-3-2-4-7-19)21(25)11-16-24-12-5-17-26-24/h2-4,6-7,20H,5,8-18H2,1H3/p+1