1-[(3-methoxyphenyl)methyl]-4-piperidin-1-ium-1-yl-piperidin-1-ium

Systemtic Name: 1-[(3-methoxyphenyl)methyl]-4-piperidin-1-ium-1-yl-piperidin-1-ium Openeye Name: 1-[(3-methoxyphenyl)methyl]-4-piperidin-1-ium-1-yl-piperidin-1-ium CAS Name: 1-[(3-methoxyphenyl)methyl]-4-(1-piperidin-1-iumyl)piperidin-1-ium IUPAC Name: 1-[(3-methoxyphenyl)methyl]-4-piperidin-1-ium-1-ylpiperidin-1-ium Traditional Name: 1-m-anisyl-4-piperidin-1-ium-1-yl-piperidin-1-ium Formula: C18H30N2O+2 MolecularWeight: 290.4436

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C[NH+]2CCC(CC2)[NH+]3CCCCC3

Isomeric SMILES

COC1=CC=CC(=C1)C[NH+]2CCC(CC2)[NH+]3CCCCC3

InChI

InChI=1S/C18H28N2O/c1-21-18-7-5-6-16(14-18)15-19-12-8-17(9-13-19)20-10-3-2-4-11-20/h5-7,14,17H,2-4,8-13,15H2,1H3/p+2