2-[4-benzamido-5-ethanoyl-2,2-bis(fluoranyl)-1-oxa-3-aza-2-boranuidacyclohex-4-en-6-ylidene]ethylidene-dimethyl-azanium

Systemtic Name: 2-[4-benzamido-5-ethanoyl-2,2-bis(fluoranyl)-1-oxa-3-aza-2-boranuidacyclohex-4-en-6-ylidene]ethylidene-dimethyl-azanium Openeye Name: 2-(5-acetyl-4-benzamido-2,2-difluoro-1-oxa-3-aza-2-boranuidacyclohex-4-en-6-ylidene)ethylidene-dimethyl-ammonium CAS Name: 2-(5-acetyl-4-benzamido-2,2-difluoro-1-oxa-3-aza-2-boranuidacyclohex-4-en-6-ylidene)ethylidene-dimethylammonium IUPAC Name: 2-(5-acetyl-4-benzamido-2,2-difluoro-1-oxa-3-aza-2-boranuidacyclohex-4-en-6-ylidene)ethylidene-dimethylazanium Traditional Name: 2-(5-acetyl-4-benzamido-2,2-difluoro-1-oxa-3-aza-2-boranuidacyclohex-4-en-6-ylidene)ethylidene-dimethyl-ammonium Formula: C16H18BF2N3O3 MolecularWeight: 349.140226

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Descriptors Computed from Structure

Canonical SMILES:

[B-]1(NC(=C(C(=CC=[N+](C)C)O1)C(=O)C)NC(=O)C2=CC=CC=C2)(F)F

Isomeric SMILES

[B-]1(NC(=C(C(=CC=[N+](C)C)O1)C(=O)C)NC(=O)C2=CC=CC=C2)(F)F

InChI

InChI=1S/C16H17BF2N3O3/c1-11(23)14-13(9-10-22(2)3)25-17(18,19)21-15(14)20-16(24)12-7-5-4-6-8-12/h4-10H,1-3H3,(H,20,21,24)/q-1/p+1