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

Systemtic Name: [C-(4-butoxynaphthalen-1-yl)carbonimidoyl]-dihexyl-azanium chloride Openeye Name: (4-butoxynaphthalene-1-carboximidoyl)-dihexyl-ammonium chloride CAS Name: [(4-butoxy-1-naphthalenyl)-iminomethyl]-dihexylammonium chloride IUPAC Name: (4-butoxynaphthalene-1-carboximidoyl)-dihexylazanium chloride Traditional Name: (4-butoxynaphthalene-1-carboximidoyl)-dihexyl-ammonium chloride Formula: C27H43ClN2O MolecularWeight: 447.09612

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H42N2O.ClH/c1-4-7-10-14-20-29(21-15-11-8-5-2)27(28)25-18-19-26(30-22-9-6-3)24-17-13-12-16-23(24)25;/h12-13,16-19,28H,4-11,14-15,20-22H2,1-3H3;1H