(4-phenoxyphenyl)-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: (4-phenoxyphenyl)-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (4-benzylpiperazin-4-ium-1-yl)-(4-phenoxyphenyl)methanone CAS Name: (4-phenoxyphenyl)-[4-(phenylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (4-benzylpiperazin-4-ium-1-yl)-(4-phenoxyphenyl)methanone Traditional Name: (4-benzylpiperazin-4-ium-1-yl)-(4-phenoxyphenyl)methanone Formula: C24H25N2O2+ MolecularWeight: 373.4675

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

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