N-[2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]carbonylphenyl]cyclohexanecarboxamide

Systemtic Name: N-[2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]carbonylphenyl]cyclohexanecarboxamide Openeye Name: N-[2-(4-benzhydrylpiperazin-4-ium-1-carbonyl)phenyl]cyclohexanecarboxamide CAS Name: N-[2-[[4-(diphenylmethyl)-1-piperazin-4-iumyl]-oxomethyl]phenyl]cyclohexanecarboxamide IUPAC Name: N-[2-(4-benzhydrylpiperazin-4-ium-1-carbonyl)phenyl]cyclohexanecarboxamide Traditional Name: N-[2-(4-benzhydrylpiperazin-4-ium-1-carbonyl)phenyl]cyclohexanecarboxamide Formula: C31H36N3O2+ MolecularWeight: 482.63644

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=CC=CC=C2C(=O)N3CC[NH+](CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=CC=CC=C2C(=O)N3CC[NH+](CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H35N3O2/c35-30(26-16-8-3-9-17-26)32-28-19-11-10-18-27(28)31(36)34-22-20-33(21-23-34)29(24-12-4-1-5-13-24)25-14-6-2-7-15-25/h1-2,4-7,10-15,18-19,26,29H,3,8-9,16-17,20-23H2,(H,32,35)/p+1