2-[[azanyl(pyrrolidin-1-ium-1-ylidene)methyl]amino]-1-phenyl-ethanone chloride

Systemtic Name: 2-[[azanyl(pyrrolidin-1-ium-1-ylidene)methyl]amino]-1-phenyl-ethanone chloride Openeye Name: 2-[[amino(pyrrolidin-1-ium-1-ylidene)methyl]amino]-1-phenyl-ethanone chloride CAS Name: 2-[[amino(1-pyrrolidin-1-iumylidene)methyl]amino]-1-phenylethanone chloride IUPAC Name: 2-[[amino(pyrrolidin-1-ium-1-ylidene)methyl]amino]-1-phenylethanone chloride Traditional Name: 2-[[amino(pyrrolidin-1-ium-1-ylidene)methyl]amino]-1-phenyl-ethanone chloride Formula: C13H18ClN3O MolecularWeight: 267.75452

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](=C(N)NCC(=O)C2=CC=CC=C2)C1.[Cl-]

Isomeric SMILES

C1CC[N+](=C(N)NCC(=O)C2=CC=CC=C2)C1.[Cl-]

InChI

InChI=1S/C13H17N3O.ClH/c14-13(16-8-4-5-9-16)15-10-12(17)11-6-2-1-3-7-11;/h1-3,6-7H,4-5,8-10H2,(H2,14,15);1H