3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]propanamide

Systemtic Name: 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]propanamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-(3,5-dimethylisoxazol-4-yl)propanamide CAS Name: 3-(3,5-dimethyl-4-isoxazolyl)-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]propanamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)propanamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-(3,5-dimethylisoxazol-4-yl)propionamide Formula: C20H28N3O2+ MolecularWeight: 342.45522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CCC(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NO1)C)CCC(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H27N3O2/c1-15-19(16(2)25-22-15)8-9-20(24)21-18-10-12-23(13-11-18)14-17-6-4-3-5-7-17/h3-7,18H,8-14H2,1-2H3,(H,21,24)/p+1