3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(1-propylpiperidin-1-ium-4-yl)benzamide

Systemtic Name: 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(1-propylpiperidin-1-ium-4-yl)benzamide Openeye Name: 3-[(3,5-dimethylisoxazol-4-yl)methoxy]-N-(1-propylpiperidin-1-ium-4-yl)benzamide CAS Name: 3-[(3,5-dimethyl-4-isoxazolyl)methoxy]-N-(1-propyl-4-piperidin-1-iumyl)benzamide IUPAC Name: 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(1-propylpiperidin-1-ium-4-yl)benzamide Traditional Name: 3-[(3,5-dimethylisoxazol-4-yl)methoxy]-N-(1-propylpiperidin-1-ium-4-yl)benzamide Formula: C21H30N3O3+ MolecularWeight: 372.4812

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NC(=O)C2=CC(=CC=C2)OCC3=C(ON=C3C)C

Isomeric SMILES

CCC[NH+]1CCC(CC1)NC(=O)C2=CC(=CC=C2)OCC3=C(ON=C3C)C

InChI

InChI=1S/C21H29N3O3/c1-4-10-24-11-8-18(9-12-24)22-21(25)17-6-5-7-19(13-17)26-14-20-15(2)23-27-16(20)3/h5-7,13,18H,4,8-12,14H2,1-3H3,(H,22,25)/p+1