1-(5-chloranyl-2-methyl-phenyl)-4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-4-ium

Systemtic Name: 1-(5-chloranyl-2-methyl-phenyl)-4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-4-ium Openeye Name: 1-(5-chloro-2-methyl-phenyl)-4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-4-ium CAS Name: 1-(5-chloro-2-methylphenyl)-4-[(4,5-dimethoxy-2-methylphenyl)methyl]piperazin-4-ium IUPAC Name: 1-(5-chloro-2-methylphenyl)-4-[(4,5-dimethoxy-2-methylphenyl)methyl]piperazin-4-ium Traditional Name: 1-(5-chloro-2-methyl-phenyl)-4-(4,5-dimethoxy-2-methyl-benzyl)piperazin-4-ium Formula: C21H28ClN2O2+ MolecularWeight: 375.91222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CC[NH+](CC2)CC3=CC(=C(C=C3C)OC)OC

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CC[NH+](CC2)CC3=CC(=C(C=C3C)OC)OC

InChI

InChI=1S/C21H27ClN2O2/c1-15-5-6-18(22)13-19(15)24-9-7-23(8-10-24)14-17-12-21(26-4)20(25-3)11-16(17)2/h5-6,11-13H,7-10,14H2,1-4H3/p+1