[1-[2-(1-adamantylamino)-2-oxidanylidene-ethyl]pyridin-4-ylidene]methyl-oxidanylidene-azanium chloride

Systemtic Name: [1-[2-(1-adamantylamino)-2-oxidanylidene-ethyl]pyridin-4-ylidene]methyl-oxidanylidene-azanium chloride Openeye Name: [1-[2-(1-adamantylamino)-2-oxo-ethyl]-4-pyridylidene]methyl-oxo-ammonium chloride CAS Name: [1-[2-(1-adamantylamino)-2-oxoethyl]-4-pyridinylidene]methyl-oxoammonium chloride IUPAC Name: [1-[2-(1-adamantylamino)-2-oxoethyl]pyridin-4-ylidene]methyl-oxoazanium chloride Traditional Name: [1-[2-(1-adamantylamino)-2-keto-ethyl]-4-pyridylidene]methyl-keto-ammonium chloride Formula: C18H24ClN3O2 MolecularWeight: 349.85506

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)CN4C=CC(=C[NH+]=O)C=C4.[Cl-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)CN4C=CC(=C[NH+]=O)C=C4.[Cl-]

InChI

InChI=1S/C18H23N3O2.ClH/c22-17(12-21-3-1-13(2-4-21)11-19-23)20-18-8-14-5-15(9-18)7-16(6-14)10-18;/h1-4,11,14-16H,5-10,12H2,(H,20,22);1H