[4-(diphenylmethyl)piperazin-4-ium-1-yl]-(2-phenoxyphenyl)methanone

Systemtic Name: [4-(diphenylmethyl)piperazin-4-ium-1-yl]-(2-phenoxyphenyl)methanone Openeye Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(2-phenoxyphenyl)methanone CAS Name: [4-(diphenylmethyl)-1-piperazin-4-iumyl]-(2-phenoxyphenyl)methanone IUPAC Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(2-phenoxyphenyl)methanone Traditional Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(2-phenoxyphenyl)methanone Formula: C30H29N2O2+ MolecularWeight: 449.56346

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4OC5=CC=CC=C5

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4OC5=CC=CC=C5

InChI

InChI=1S/C30H28N2O2/c33-30(27-18-10-11-19-28(27)34-26-16-8-3-9-17-26)32-22-20-31(21-23-32)29(24-12-4-1-5-13-24)25-14-6-2-7-15-25/h1-19,29H,20-23H2/p+1