3-[bis[[(1S)-4-methylcyclohex-3-en-1-yl]methyl]azaniumyl]propyl-dimethyl-azanium

Systemtic Name: 3-[bis[[(1S)-4-methylcyclohex-3-en-1-yl]methyl]azaniumyl]propyl-dimethyl-azanium Openeye Name: 3-[bis[[(1S)-4-methylcyclohex-3-en-1-yl]methyl]ammonio]propyl-dimethyl-ammonium CAS Name: 3-[bis[[(1S)-4-methyl-1-cyclohex-3-enyl]methyl]ammonio]propyl-dimethylammonium IUPAC Name: 3-[bis[[(1S)-4-methylcyclohex-3-en-1-yl]methyl]azaniumyl]propyl-dimethylazanium Traditional Name: 3-[bis[[(1S)-4-methylcyclohex-3-en-1-yl]methyl]ammonio]propyl-dimethyl-ammonium Formula: C21H40N2+2 MolecularWeight: 320.5557

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(CC1)C[NH+](CCC[NH+](C)C)CC2CCC(=CC2)C

Isomeric SMILES

CC1=CC[C@H](CC1)C[NH+](CCC[NH+](C)C)C[C@H]2CCC(=CC2)C

InChI

InChI=1S/C21H38N2/c1-18-6-10-20(11-7-18)16-23(15-5-14-22(3)4)17-21-12-8-19(2)9-13-21/h6,8,20-21H,5,7,9-17H2,1-4H3/p+2/t20-,21-/m1/s1