[4-[(2-chloranylphenoxy)methyl]phenyl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone

Systemtic Name: [4-[(2-chloranylphenoxy)methyl]phenyl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Openeye Name: [4-[(2-chlorophenoxy)methyl]phenyl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone CAS Name: [4-[(2-chlorophenoxy)methyl]phenyl]-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methanone IUPAC Name: [4-[(2-chlorophenoxy)methyl]phenyl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Traditional Name: [4-[(2-chlorophenoxy)methyl]phenyl]-(4-pyridin-1-ium-2-ylpiperazino)methanone Formula: C23H23ClN3O2+ MolecularWeight: 408.90062

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3=CC=C(C=C3)COC4=CC=CC=C4Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3=CC=C(C=C3)COC4=CC=CC=C4Cl

InChI

InChI=1S/C23H22ClN3O2/c24-20-5-1-2-6-21(20)29-17-18-8-10-19(11-9-18)23(28)27-15-13-26(14-16-27)22-7-3-4-12-25-22/h1-12H,13-17H2/p+1