(5-butyl-2-oxidanidyl-4,5-dihydro-1,2-oxazol-2-ium-3-yl)-(4-chlorophenyl)methanone

Systemtic Name: (5-butyl-2-oxidanidyl-4,5-dihydro-1,2-oxazol-2-ium-3-yl)-(4-chlorophenyl)methanone Openeye Name: (5-butyl-2-oxido-4,5-dihydroisoxazol-2-ium-3-yl)-(4-chlorophenyl)methanone CAS Name: (5-butyl-2-oxido-4,5-dihydroisoxazol-2-ium-3-yl)-(4-chlorophenyl)methanone IUPAC Name: (5-butyl-2-oxido-4,5-dihydro-1,2-oxazol-2-ium-3-yl)-(4-chlorophenyl)methanone Traditional Name: (5-butyl-2-oxido-2-isoxazolin-2-ium-3-yl)-(4-chlorophenyl)methanone Formula: C14H16ClNO3 MolecularWeight: 281.73474

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CC(=[N+](O1)[O-])C(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCC1CC(=[N+](O1)[O-])C(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H16ClNO3/c1-2-3-4-12-9-13(16(18)19-12)14(17)10-5-7-11(15)8-6-10/h5-8,12H,2-4,9H2,1H3