1-[4-[4-(2,2-diphenylethyl)piperazin-4-ium-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-(2,2-diphenylethyl)piperazin-4-ium-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-(2,2-diphenylethyl)piperazin-4-ium-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-(2,2-diphenylethyl)-1-piperazin-4-iumyl]phenyl]ethanone IUPAC Name: 1-[4-[4-(2,2-diphenylethyl)piperazin-4-ium-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-(2,2-diphenylethyl)piperazin-4-ium-1-yl]phenyl]ethanone Formula: C26H29N2O+ MolecularWeight: 385.52126

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H28N2O/c1-21(29)22-12-14-25(15-13-22)28-18-16-27(17-19-28)20-26(23-8-4-2-5-9-23)24-10-6-3-7-11-24/h2-15,26H,16-20H2,1H3/p+1