(2-chloranylpyridin-3-yl)-[4-(diphenylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: (2-chloranylpyridin-3-yl)-[4-(diphenylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(2-chloro-3-pyridyl)methanone CAS Name: (2-chloro-3-pyridinyl)-[4-(diphenylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(2-chloropyridin-3-yl)methanone Traditional Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(2-chloro-3-pyridyl)methanone Formula: C23H23ClN3O+ MolecularWeight: 392.90122

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=C(N=CC=C4)Cl

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=C(N=CC=C4)Cl

InChI

InChI=1S/C23H22ClN3O/c24-22-20(12-7-13-25-22)23(28)27-16-14-26(15-17-27)21(18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-13,21H,14-17H2/p+1