5-[(2,6-dimethylphenoxy)methyl]-N-ethyl-N-(2-pyrrolidin-1-ium-1-ylethyl)-1,2-oxazole-3-carboxamide

Systemtic Name: 5-[(2,6-dimethylphenoxy)methyl]-N-ethyl-N-(2-pyrrolidin-1-ium-1-ylethyl)-1,2-oxazole-3-carboxamide Openeye Name: 5-[(2,6-dimethylphenoxy)methyl]-N-ethyl-N-(2-pyrrolidin-1-ium-1-ylethyl)isoxazole-3-carboxamide CAS Name: 5-[(2,6-dimethylphenoxy)methyl]-N-ethyl-N-[2-(1-pyrrolidin-1-iumyl)ethyl]-3-isoxazolecarboxamide IUPAC Name: 5-[(2,6-dimethylphenoxy)methyl]-N-ethyl-N-(2-pyrrolidin-1-ium-1-ylethyl)-1,2-oxazole-3-carboxamide Traditional Name: 5-[(2,6-dimethylphenoxy)methyl]-N-ethyl-N-(2-pyrrolidin-1-ium-1-ylethyl)isoxazole-3-carboxamide Formula: C21H30N3O3+ MolecularWeight: 372.4812

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC[NH+]1CCCC1)C(=O)C2=NOC(=C2)COC3=C(C=CC=C3C)C

Isomeric SMILES

CCN(CC[NH+]1CCCC1)C(=O)C2=NOC(=C2)COC3=C(C=CC=C3C)C

InChI

InChI=1S/C21H29N3O3/c1-4-24(13-12-23-10-5-6-11-23)21(25)19-14-18(27-22-19)15-26-20-16(2)8-7-9-17(20)3/h7-9,14H,4-6,10-13,15H2,1-3H3/p+1