1-[2-[(4S)-2,2-dimethyl-4-(4-methylphenyl)oxan-4-yl]ethyl]-4-methyl-piperazine-1,4-diium

Systemtic Name: 1-[2-[(4S)-2,2-dimethyl-4-(4-methylphenyl)oxan-4-yl]ethyl]-4-methyl-piperazine-1,4-diium Openeye Name: 1-[2-[(4S)-2,2-dimethyl-4-(p-tolyl)tetrahydropyran-4-yl]ethyl]-4-methyl-piperazine-1,4-diium CAS Name: 1-[2-[(4S)-2,2-dimethyl-4-(4-methylphenyl)-4-oxanyl]ethyl]-4-methylpiperazine-1,4-diium IUPAC Name: 1-[2-[(4S)-2,2-dimethyl-4-(4-methylphenyl)oxan-4-yl]ethyl]-4-methylpiperazine-1,4-diium Traditional Name: 1-[2-[(4S)-2,2-dimethyl-4-(p-tolyl)tetrahydropyran-4-yl]ethyl]-4-methyl-piperazine-1,4-diium Formula: C21H36N2O+2 MolecularWeight: 332.52334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2(CCOC(C2)(C)C)CC[NH+]3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC=C(C=C1)[C@]2(CCOC(C2)(C)C)CC[NH+]3CC[NH+](CC3)C

InChI

InChI=1S/C21H34N2O/c1-18-5-7-19(8-6-18)21(10-16-24-20(2,3)17-21)9-11-23-14-12-22(4)13-15-23/h5-8H,9-17H2,1-4H3/p+2/t21-/m0/s1