1,4-diazepan-4-ium-1-yl(1H-indazol-3-yl)methanone

Systemtic Name: 1,4-diazepan-4-ium-1-yl(1H-indazol-3-yl)methanone Openeye Name: 1,4-diazepan-4-ium-1-yl(1H-indazol-3-yl)methanone CAS Name: 1,4-diazepan-4-ium-1-yl(1H-indazol-3-yl)methanone IUPAC Name: 1,4-diazepan-4-ium-1-yl(1H-indazol-3-yl)methanone Traditional Name: 1,4-diazepan-4-ium-1-yl(1H-indazol-3-yl)methanone Formula: C13H17N4O+ MolecularWeight: 245.30028

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCN(C1)C(=O)C2=NNC3=CC=CC=C32

Isomeric SMILES

C1C[NH2+]CCN(C1)C(=O)C2=NNC3=CC=CC=C32

InChI

InChI=1S/C13H16N4O/c18-13(17-8-3-6-14-7-9-17)12-10-4-1-2-5-11(10)15-16-12/h1-2,4-5,14H,3,6-9H2,(H,15,16)/p+1