3,5-dimethoxy-N-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]-N-(2-pyrrolidin-1-ium-1-ylethyl)benzamide

Systemtic Name: 3,5-dimethoxy-N-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]-N-(2-pyrrolidin-1-ium-1-ylethyl)benzamide Openeye Name: N-[2-(isoxazol-3-ylamino)-2-oxo-ethyl]-3,5-dimethoxy-N-(2-pyrrolidin-1-ium-1-ylethyl)benzamide CAS Name: N-[2-(3-isoxazolylamino)-2-oxoethyl]-3,5-dimethoxy-N-[2-(1-pyrrolidin-1-iumyl)ethyl]benzamide IUPAC Name: 3,5-dimethoxy-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-(2-pyrrolidin-1-ium-1-ylethyl)benzamide Traditional Name: N-[2-(isoxazol-3-ylamino)-2-keto-ethyl]-3,5-dimethoxy-N-(2-pyrrolidin-1-ium-1-ylethyl)benzamide Formula: C20H27N4O5+ MolecularWeight: 403.45218

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)N(CC[NH+]2CCCC2)CC(=O)NC3=NOC=C3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)N(CC[NH+]2CCCC2)CC(=O)NC3=NOC=C3)OC

InChI

InChI=1S/C20H26N4O5/c1-27-16-11-15(12-17(13-16)28-2)20(26)24(9-8-23-6-3-4-7-23)14-19(25)21-18-5-10-29-22-18/h5,10-13H,3-4,6-9,14H2,1-2H3,(H,21,22,25)/p+1