3-cyclohexyl-1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]propan-1-one

Systemtic Name: 3-cyclohexyl-1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]propan-1-one Openeye Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-3-cyclohexyl-propan-1-one CAS Name: 3-cyclohexyl-1-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-1-propanone IUPAC Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-3-cyclohexylpropan-1-one Traditional Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-3-cyclohexyl-propan-1-one Formula: C26H35N2O+ MolecularWeight: 391.5689

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)CCC(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H34N2O/c29-25(17-16-22-10-4-1-5-11-22)27-18-20-28(21-19-27)26(23-12-6-2-7-13-23)24-14-8-3-9-15-24/h2-3,6-9,12-15,22,26H,1,4-5,10-11,16-21H2/p+1