[4-(4-methoxyphenyl)piperazin-4-ium-1-yl]-phenyl-methanone chloride

Systemtic Name: [4-(4-methoxyphenyl)piperazin-4-ium-1-yl]-phenyl-methanone chloride Openeye Name: [4-(4-methoxyphenyl)piperazin-4-ium-1-yl]-phenyl-methanone chloride CAS Name: [4-(4-methoxyphenyl)-1-piperazin-4-iumyl]-phenylmethanone chloride IUPAC Name: [4-(4-methoxyphenyl)piperazin-4-ium-1-yl]-phenylmethanone chloride Traditional Name: [4-(4-methoxyphenyl)piperazin-4-ium-1-yl]-phenyl-methanone chloride Formula: C18H21ClN2O2 MolecularWeight: 332.82454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

COC1=CC=C(C=C1)[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C18H20N2O2.ClH/c1-22-17-9-7-16(8-10-17)19-11-13-20(14-12-19)18(21)15-5-3-2-4-6-15;/h2-10H,11-14H2,1H3;1H