[4-(phenylmethyl)piperazin-4-ium-1-yl]-pyridin-4-yl-methanone

Systemtic Name: [4-(phenylmethyl)piperazin-4-ium-1-yl]-pyridin-4-yl-methanone Openeye Name: (4-benzylpiperazin-4-ium-1-yl)-(4-pyridyl)methanone CAS Name: [4-(phenylmethyl)-1-piperazin-4-iumyl]-pyridin-4-ylmethanone IUPAC Name: (4-benzylpiperazin-4-ium-1-yl)-pyridin-4-ylmethanone Traditional Name: (4-benzylpiperazin-4-ium-1-yl)-(4-pyridyl)methanone Formula: C17H20N3O+ MolecularWeight: 282.3602

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)C3=CC=NC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)C3=CC=NC=C3

InChI

InChI=1S/C17H19N3O/c21-17(16-6-8-18-9-7-16)20-12-10-19(11-13-20)14-15-4-2-1-3-5-15/h1-9H,10-14H2/p+1