(5E)-5-(dimethylaminomethylidene)-7-oxidanyl-3,4-dihydro-2H-azepin-1-ium-6-one

Systemtic Name: (5E)-5-(dimethylaminomethylidene)-7-oxidanyl-3,4-dihydro-2H-azepin-1-ium-6-one Openeye Name: (5E)-5-(dimethylaminomethylene)-7-hydroxy-3,4-dihydro-2H-azepin-1-ium-6-one CAS Name: (5E)-5-(dimethylaminomethylidene)-7-hydroxy-3,4-dihydro-2H-azepin-1-ium-6-one IUPAC Name: (5E)-5-(dimethylaminomethylidene)-7-hydroxy-3,4-dihydro-2H-azepin-1-ium-6-one Traditional Name: (5E)-5-(dimethylaminomethylene)-7-hydroxy-3,4-dihydro-2H-azepin-1-ium-6-one Formula: C9H15N2O2+ MolecularWeight: 183.2276

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=C1CCC[NH+]=C(C1=O)O

Isomeric SMILES

CN(C)/C=C/1\CCC[NH+]=C(C1=O)O

InChI

InChI=1S/C9H14N2O2/c1-11(2)6-7-4-3-5-10-9(13)8(7)12/h6H,3-5H2,1-2H3,(H,10,13)/p+1/b7-6+