N-[azanyl(pyrrolidin-1-ium-1-ylidene)methyl]-3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-1,2-oxazole-4-carboxamide

Systemtic Name: N-[azanyl(pyrrolidin-1-ium-1-ylidene)methyl]-3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-1,2-oxazole-4-carboxamide Openeye Name: N-[amino(pyrrolidin-1-ium-1-ylidene)methyl]-3-(2-chloro-6-fluoro-phenyl)-5-methyl-isoxazole-4-carboxamide CAS Name: N-[amino(1-pyrrolidin-1-iumylidene)methyl]-3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolecarboxamide IUPAC Name: N-[amino(pyrrolidin-1-ium-1-ylidene)methyl]-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide Traditional Name: N-[amino(pyrrolidin-1-ium-1-ylidene)methyl]-3-(2-chloro-6-fluoro-phenyl)-5-methyl-isoxazole-4-carboxamide Formula: C16H17ClFN4O2+ MolecularWeight: 351.783183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)NC(=[N+]3CCCC3)N

Isomeric SMILES

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)NC(=[N+]3CCCC3)N

InChI

InChI=1S/C16H16ClFN4O2/c1-9-12(15(23)20-16(19)22-7-2-3-8-22)14(21-24-9)13-10(17)5-4-6-11(13)18/h4-6H,2-3,7-8H2,1H3,(H2,19,20,23)/p+1