[C-(4-butoxynaphthalen-1-yl)carbonimidoyl]-dioctyl-azanium chloride

Systemtic Name: [C-(4-butoxynaphthalen-1-yl)carbonimidoyl]-dioctyl-azanium chloride Openeye Name: (4-butoxynaphthalene-1-carboximidoyl)-dioctyl-ammonium chloride CAS Name: [(4-butoxy-1-naphthalenyl)-iminomethyl]-dioctylammonium chloride IUPAC Name: (4-butoxynaphthalene-1-carboximidoyl)-dioctylazanium chloride Traditional Name: (4-butoxynaphthalene-1-carboximidoyl)-dioctyl-ammonium chloride Formula: C31H51ClN2O MolecularWeight: 503.20244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[NH+](CCCCCCCC)C(=N)C1=CC=C(C2=CC=CC=C21)OCCCC.[Cl-]

Isomeric SMILES

CCCCCCCC[NH+](CCCCCCCC)C(=N)C1=CC=C(C2=CC=CC=C21)OCCCC.[Cl-]

InChI

InChI=1S/C31H50N2O.ClH/c1-4-7-10-12-14-18-24-33(25-19-15-13-11-8-5-2)31(32)29-22-23-30(34-26-9-6-3)28-21-17-16-20-27(28)29;/h16-17,20-23,32H,4-15,18-19,24-26H2,1-3H3;1H