1-[(4-methoxy-2,5-dimethyl-phenyl)methyl]-4-piperidin-1-ium-1-yl-piperidin-1-ium

Systemtic Name: 1-[(4-methoxy-2,5-dimethyl-phenyl)methyl]-4-piperidin-1-ium-1-yl-piperidin-1-ium Openeye Name: 1-[(4-methoxy-2,5-dimethyl-phenyl)methyl]-4-piperidin-1-ium-1-yl-piperidin-1-ium CAS Name: 1-[(4-methoxy-2,5-dimethylphenyl)methyl]-4-(1-piperidin-1-iumyl)piperidin-1-ium IUPAC Name: 1-[(4-methoxy-2,5-dimethylphenyl)methyl]-4-piperidin-1-ium-1-ylpiperidin-1-ium Traditional Name: 1-(4-methoxy-2,5-dimethyl-benzyl)-4-piperidin-1-ium-1-yl-piperidin-1-ium Formula: C20H34N2O+2 MolecularWeight: 318.49676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C[NH+]2CCC(CC2)[NH+]3CCCCC3)C)OC

Isomeric SMILES

CC1=CC(=C(C=C1C[NH+]2CCC(CC2)[NH+]3CCCCC3)C)OC

InChI

InChI=1S/C20H32N2O/c1-16-14-20(23-3)17(2)13-18(16)15-21-11-7-19(8-12-21)22-9-5-4-6-10-22/h13-14,19H,4-12,15H2,1-3H3/p+2