(2-chloranyl-6-fluoranyl-phenyl)-[4-[(3-methoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)-[4-[(3-methoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (2-chloro-6-fluoro-phenyl)-[4-[(3-methoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone CAS Name: (2-chloro-6-fluorophenyl)-[4-[(3-methoxyphenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (2-chloro-6-fluorophenyl)-[4-[(3-methoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (2-chloro-6-fluoro-phenyl)-(4-m-anisylpiperazin-4-ium-1-yl)methanone Formula: C19H21ClFN2O2+ MolecularWeight: 363.833643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C[NH+]2CCN(CC2)C(=O)C3=C(C=CC=C3Cl)F

Isomeric SMILES

COC1=CC=CC(=C1)C[NH+]2CCN(CC2)C(=O)C3=C(C=CC=C3Cl)F

InChI

InChI=1S/C19H20ClFN2O2/c1-25-15-5-2-4-14(12-15)13-22-8-10-23(11-9-22)19(24)18-16(20)6-3-7-17(18)21/h2-7,12H,8-11,13H2,1H3/p+1