(4-phenylphenyl)-[4-(pyridin-2-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: (4-phenylphenyl)-[4-(pyridin-2-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (4-phenylphenyl)-[4-(2-pyridylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: (4-phenylphenyl)-[4-(2-pyridinylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (4-phenylphenyl)-[4-(pyridin-2-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: (4-phenylphenyl)-[4-(2-pyridylmethyl)piperazin-4-ium-1-yl]methanone Formula: C23H24N3O+ MolecularWeight: 358.45616

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=N2)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=N2)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H23N3O/c27-23(21-11-9-20(10-12-21)19-6-2-1-3-7-19)26-16-14-25(15-17-26)18-22-8-4-5-13-24-22/h1-13H,14-18H2/p+1