1-(5-chloranyl-2-methyl-phenyl)-4-(2,2-diphenylethyl)piperazin-4-ium

Systemtic Name: 1-(5-chloranyl-2-methyl-phenyl)-4-(2,2-diphenylethyl)piperazin-4-ium Openeye Name: 1-(5-chloro-2-methyl-phenyl)-4-(2,2-diphenylethyl)piperazin-4-ium CAS Name: 1-(5-chloro-2-methylphenyl)-4-(2,2-diphenylethyl)piperazin-4-ium IUPAC Name: 1-(5-chloro-2-methylphenyl)-4-(2,2-diphenylethyl)piperazin-4-ium Traditional Name: 1-(5-chloro-2-methyl-phenyl)-4-(2,2-diphenylethyl)piperazin-4-ium Formula: C25H28ClN2+ MolecularWeight: 391.95622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CC[NH+](CC2)CC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CC[NH+](CC2)CC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H27ClN2/c1-20-12-13-23(26)18-25(20)28-16-14-27(15-17-28)19-24(21-8-4-2-5-9-21)22-10-6-3-7-11-22/h2-13,18,24H,14-17,19H2,1H3/p+1