(2-phenylmethoxyphenyl)-[4-(pyridin-3-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: (2-phenylmethoxyphenyl)-[4-(pyridin-3-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (2-benzyloxyphenyl)-[4-(3-pyridylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: (2-phenylmethoxyphenyl)-[4-(3-pyridinylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (2-phenylmethoxyphenyl)-[4-(pyridin-3-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: (2-benzoxyphenyl)-[4-(3-pyridylmethyl)piperazin-4-ium-1-yl]methanone Formula: C24H26N3O2+ MolecularWeight: 388.48214

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CN=CC=C2)C(=O)C3=CC=CC=C3OCC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CN=CC=C2)C(=O)C3=CC=CC=C3OCC4=CC=CC=C4

InChI

InChI=1S/C24H25N3O2/c28-24(27-15-13-26(14-16-27)18-21-9-6-12-25-17-21)22-10-4-5-11-23(22)29-19-20-7-2-1-3-8-20/h1-12,17H,13-16,18-19H2/p+1