diphenyl-[4-(pyridin-3-ylmethyl)piperazin-4-ium-1-yl]methanol

Systemtic Name: diphenyl-[4-(pyridin-3-ylmethyl)piperazin-4-ium-1-yl]methanol Openeye Name: diphenyl-[4-(3-pyridylmethyl)piperazin-4-ium-1-yl]methanol CAS Name: diphenyl-[4-(3-pyridinylmethyl)-1-piperazin-4-iumyl]methanol IUPAC Name: diphenyl-[4-(pyridin-3-ylmethyl)piperazin-4-ium-1-yl]methanol Traditional Name: diphenyl-[4-(3-pyridylmethyl)piperazin-4-ium-1-yl]methanol Formula: C23H26N3O+ MolecularWeight: 360.47204

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25N3O/c27-23(21-9-3-1-4-10-21,22-11-5-2-6-12-22)26-16-14-25(15-17-26)19-20-8-7-13-24-18-20/h1-13,18,27H,14-17,19H2/p+1