[(2Z)-2-(5-ethanoyl-4-methylsulfanyl-2,2-diphenyl-1-oxa-3-aza-2-boranuidacyclohex-4-en-6-ylidene)ethylidene]-dimethyl-azanium

Systemtic Name: [(2Z)-2-(5-ethanoyl-4-methylsulfanyl-2,2-diphenyl-1-oxa-3-aza-2-boranuidacyclohex-4-en-6-ylidene)ethylidene]-dimethyl-azanium Openeye Name: [(2Z)-2-(5-acetyl-4-methylsulfanyl-2,2-diphenyl-1-oxa-3-aza-2-boranuidacyclohex-4-en-6-ylidene)ethylidene]-dimethyl-ammonium CAS Name: [(2Z)-2-[5-acetyl-4-(methylthio)-2,2-diphenyl-1-oxa-3-aza-2-boranuidacyclohex-4-en-6-ylidene]ethylidene]-dimethylammonium IUPAC Name: [(2Z)-2-(5-acetyl-4-methylsulfanyl-2,2-diphenyl-1-oxa-3-aza-2-boranuidacyclohex-4-en-6-ylidene)ethylidene]-dimethylazanium Traditional Name: [(2Z)-2-[5-acetyl-4-(methylthio)-2,2-diphenyl-1-oxa-3-aza-2-boranuidacyclohex-4-en-6-ylidene]ethylidene]-dimethyl-ammonium Formula: C22H25BN2O2S MolecularWeight: 392.3221

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Descriptors Computed from Structure

Canonical SMILES:

[B-]1(NC(=C(C(=CC=[N+](C)C)O1)C(=O)C)SC)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

[B-]1(NC(=C(/C(=C/C=[N+](C)C)/O1)C(=O)C)SC)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H24BN2O2S/c1-17(26)21-20(15-16-25(2)3)27-23(24-22(21)28-4,18-11-7-5-8-12-18)19-13-9-6-10-14-19/h5-16H,1-4H3/q-1/p+1