1-(4-cycloheptylpiperazin-4-ium-1-yl)-2,2-diphenyl-ethanone

Systemtic Name: 1-(4-cycloheptylpiperazin-4-ium-1-yl)-2,2-diphenyl-ethanone Openeye Name: 1-(4-cycloheptylpiperazin-4-ium-1-yl)-2,2-diphenyl-ethanone CAS Name: 1-(4-cycloheptyl-1-piperazin-4-iumyl)-2,2-diphenylethanone IUPAC Name: 1-(4-cycloheptylpiperazin-4-ium-1-yl)-2,2-diphenylethanone Traditional Name: 1-(4-cycloheptylpiperazin-4-ium-1-yl)-2,2-diphenyl-ethanone Formula: C25H33N2O+ MolecularWeight: 377.54232

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)[NH+]2CCN(CC2)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCCC(CC1)[NH+]2CCN(CC2)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H32N2O/c28-25(24(21-11-5-3-6-12-21)22-13-7-4-8-14-22)27-19-17-26(18-20-27)23-15-9-1-2-10-16-23/h3-8,11-14,23-24H,1-2,9-10,15-20H2/p+1