2-methyl-5-(phenylmethyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-2-ium-3-amine

Systemtic Name: 2-methyl-5-(phenylmethyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-2-ium-3-amine Openeye Name: 5-benzyl-2-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-2-ium-3-amine CAS Name: 2-methyl-5-(phenylmethyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-2-ium-3-amine IUPAC Name: 5-benzyl-2-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-2-ium-3-amine Traditional Name: (5-benzyl-2-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-2-ium-3-yl)amine Formula: C14H19N4+ MolecularWeight: 243.32746

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C2=C(N1)CCN(C2)CC3=CC=CC=C3)N

Isomeric SMILES

C[N+]1=C(C2=C(N1)CCN(C2)CC3=CC=CC=C3)N

InChI

InChI=1S/C14H18N4/c1-17-14(15)12-10-18(8-7-13(12)16-17)9-11-5-3-2-4-6-11/h2-6H,7-10H2,1H3,(H2,15,16)/p+1