[4-[(3-phenoxyphenyl)methyl]piperazin-4-ium-1-yl]-phenyl-methanone

Systemtic Name: [4-[(3-phenoxyphenyl)methyl]piperazin-4-ium-1-yl]-phenyl-methanone Openeye Name: [4-[(3-phenoxyphenyl)methyl]piperazin-4-ium-1-yl]-phenyl-methanone CAS Name: [4-[(3-phenoxyphenyl)methyl]-1-piperazin-4-iumyl]-phenylmethanone IUPAC Name: [4-[(3-phenoxyphenyl)methyl]piperazin-4-ium-1-yl]-phenylmethanone Traditional Name: [4-(3-phenoxybenzyl)piperazin-4-ium-1-yl]-phenyl-methanone Formula: C24H25N2O2+ MolecularWeight: 373.4675

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC(=CC=C2)OC3=CC=CC=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC(=CC=C2)OC3=CC=CC=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H24N2O2/c27-24(21-9-3-1-4-10-21)26-16-14-25(15-17-26)19-20-8-7-13-23(18-20)28-22-11-5-2-6-12-22/h1-13,18H,14-17,19H2/p+1