6-azanyl-2-chloranyl-1-decyl-4-(decylamino)pyridin-1-ium-3-carbonitrile chloride

Systemtic Name: 6-azanyl-2-chloranyl-1-decyl-4-(decylamino)pyridin-1-ium-3-carbonitrile chloride Openeye Name: 6-amino-2-chloro-1-decyl-4-(decylamino)pyridin-1-ium-3-carbonitrile chloride CAS Name: 6-amino-2-chloro-1-decyl-4-(decylamino)-3-pyridin-1-iumcarbonitrile chloride IUPAC Name: 6-amino-2-chloro-1-decyl-4-(decylamino)pyridin-1-ium-3-carbonitrile chloride Traditional Name: 6-amino-2-chloro-1-decyl-4-(decylamino)pyridin-1-ium-3-carbonitrile chloride Formula: C26H46Cl2N4 MolecularWeight: 485.57624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCNC1=CC(=[N+](C(=C1C#N)Cl)CCCCCCCCCC)N.[Cl-]

Isomeric SMILES

CCCCCCCCCCNC1=CC(=[N+](C(=C1C#N)Cl)CCCCCCCCCC)N.[Cl-]

InChI

InChI=1S/C26H45ClN4.ClH/c1-3-5-7-9-11-13-15-17-19-30-24-21-25(29)31(26(27)23(24)22-28)20-18-16-14-12-10-8-6-4-2;/h21H,3-20H2,1-2H3,(H2,29,30);1H