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

Systemtic Name: N-[2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]carbonylphenyl]butanamide Openeye Name: N-[2-(4-benzhydrylpiperazin-4-ium-1-carbonyl)phenyl]butanamide CAS Name: N-[2-[[4-(diphenylmethyl)-1-piperazin-4-iumyl]-oxomethyl]phenyl]butanamide IUPAC Name: N-[2-(4-benzhydrylpiperazin-4-ium-1-carbonyl)phenyl]butanamide Traditional Name: N-[2-(4-benzhydrylpiperazin-4-ium-1-carbonyl)phenyl]butyramide Formula: C28H32N3O2+ MolecularWeight: 442.57258

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=CC=C1C(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCC(=O)NC1=CC=CC=C1C(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H31N3O2/c1-2-11-26(32)29-25-17-10-9-16-24(25)28(33)31-20-18-30(19-21-31)27(22-12-5-3-6-13-22)23-14-7-4-8-15-23/h3-10,12-17,27H,2,11,18-21H2,1H3,(H,29,32)/p+1