1-(4-phenylmethoxyphenyl)-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanimine

Systemtic Name: 1-(4-phenylmethoxyphenyl)-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanimine Openeye Name: 1-(4-benzyloxyphenyl)-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanimine CAS Name: 1-(4-phenylmethoxyphenyl)-N-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methanimine IUPAC Name: 1-(4-phenylmethoxyphenyl)-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanimine Traditional Name: (E)-(4-benzoxybenzylidene)-(4-pyridin-1-ium-2-ylpiperazino)amine Formula: C23H25N4O+ MolecularWeight: 373.4708

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)N=CC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)/N=C/C3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C23H24N4O/c1-2-6-21(7-3-1)19-28-22-11-9-20(10-12-22)18-25-27-16-14-26(15-17-27)23-8-4-5-13-24-23/h1-13,18H,14-17,19H2/p+1/b25-18+