[4-(phenylmethyl)piperazin-4-ium-1-yl]-pyridin-3-yl-methanone

Systemtic Name: [4-(phenylmethyl)piperazin-4-ium-1-yl]-pyridin-3-yl-methanone Openeye Name: (4-benzylpiperazin-4-ium-1-yl)-(3-pyridyl)methanone CAS Name: [4-(phenylmethyl)-1-piperazin-4-iumyl]-(3-pyridinyl)methanone IUPAC Name: (4-benzylpiperazin-4-ium-1-yl)-pyridin-3-ylmethanone Traditional Name: (4-benzylpiperazin-4-ium-1-yl)-(3-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=CN=CC=C3

Isomeric SMILES

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

InChI

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