8-chloranyl-N-[2-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)ethyl]quinoline-2-carboxamide

Systemtic Name: 8-chloranyl-N-[2-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)ethyl]quinoline-2-carboxamide Openeye Name: 8-chloro-N-[2-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)ethyl]quinoline-2-carboxamide CAS Name: 8-chloro-N-[2-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)ethyl]-2-quinolinecarboxamide IUPAC Name: 8-chloro-N-[2-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)ethyl]quinoline-2-carboxamide Traditional Name: 8-chloro-N-[2-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)ethyl]quinaldamide Formula: C13H10ClN6O- MolecularWeight: 301.7111

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Cl)N=C(C=C2)C(=O)NCCC3=NN=N[N-]3

Isomeric SMILES

C1=CC2=C(C(=C1)Cl)N=C(C=C2)C(=O)NCCC3=NN=N[N-]3

InChI

InChI=1S/C13H11ClN6O/c14-9-3-1-2-8-4-5-10(16-12(8)9)13(21)15-7-6-11-17-19-20-18-11/h1-5H,6-7H2,(H2,15,17,18,19,20,21)/p-1