(4-methylpiperazin-4-ium-1-yl)-(3-phenylmethoxyphenyl)methanone

Systemtic Name: (4-methylpiperazin-4-ium-1-yl)-(3-phenylmethoxyphenyl)methanone Openeye Name: (3-benzyloxyphenyl)-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: (4-methyl-1-piperazin-4-iumyl)-(3-phenylmethoxyphenyl)methanone IUPAC Name: (4-methylpiperazin-4-ium-1-yl)-(3-phenylmethoxyphenyl)methanone Traditional Name: (3-benzoxyphenyl)-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C19H23N2O2+ MolecularWeight: 311.39812

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=CC(=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=CC(=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C19H22N2O2/c1-20-10-12-21(13-11-20)19(22)17-8-5-9-18(14-17)23-15-16-6-3-2-4-7-16/h2-9,14H,10-13,15H2,1H3/p+1