(5-chloranyl-7-piperazin-4-ium-1-yl-1,8-naphthyridin-2-yl)azanium dichloride

Systemtic Name: (5-chloranyl-7-piperazin-4-ium-1-yl-1,8-naphthyridin-2-yl)azanium dichloride Openeye Name: (5-chloro-7-piperazin-4-ium-1-yl-1,8-naphthyridin-2-yl)ammonium dichloride CAS Name: [5-chloro-7-(1-piperazin-4-iumyl)-1,8-naphthyridin-2-yl]ammonium dichloride IUPAC Name: (5-chloro-7-piperazin-4-ium-1-yl-1,8-naphthyridin-2-yl)azanium dichloride Traditional Name: (5-chloro-7-piperazin-4-ium-1-yl-1,8-naphthyridin-2-yl)ammonium dichloride Formula: C12H16Cl3N5 MolecularWeight: 336.64794

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=NC3=C(C=CC(=N3)[NH3+])C(=C2)Cl.[Cl-].[Cl-]

Isomeric SMILES

C1CN(CC[NH2+]1)C2=NC3=C(C=CC(=N3)[NH3+])C(=C2)Cl.[Cl-].[Cl-]

InChI

InChI=1S/C12H14ClN5.2ClH/c13-9-7-11(18-5-3-15-4-6-18)17-12-8(9)1-2-10(14)16-12;;/h1-2,7,15H,3-6H2,(H2,14,16,17);2*1H