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

Systemtic Name: [4-(diphenylmethyl)piperazin-4-ium-1-yl]-(4-iodophenyl)methanone Openeye Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(4-iodophenyl)methanone CAS Name: [4-(diphenylmethyl)-1-piperazin-4-iumyl]-(4-iodophenyl)methanone IUPAC Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(4-iodophenyl)methanone Traditional Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(4-iodophenyl)methanone Formula: C24H24IN2O+ MolecularWeight: 483.36463

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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=C(C=C4)I

Isomeric SMILES

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

InChI

InChI=1S/C24H23IN2O/c25-22-13-11-21(12-14-22)24(28)27-17-15-26(16-18-27)23(19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-14,23H,15-18H2/p+1