1-[(3,4-dimethoxyphenyl)methyl]-4-[(1S,3R)-3-methylcyclohexyl]piperazine-1,4-diium

Systemtic Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-[(1S,3R)-3-methylcyclohexyl]piperazine-1,4-diium Openeye Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-[(1S,3R)-3-methylcyclohexyl]piperazine-1,4-diium CAS Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-[(1S,3R)-3-methylcyclohexyl]piperazine-1,4-diium IUPAC Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-[(1S,3R)-3-methylcyclohexyl]piperazine-1,4-diium Traditional Name: 1-[(1S,3R)-3-methylcyclohexyl]-4-veratryl-piperazine-1,4-diium Formula: C20H34N2O2+2 MolecularWeight: 334.49616

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)[NH+]2CC[NH+](CC2)CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

C[C@@H]1CCC[C@@H](C1)[NH+]2CC[NH+](CC2)CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H32N2O2/c1-16-5-4-6-18(13-16)22-11-9-21(10-12-22)15-17-7-8-19(23-2)20(14-17)24-3/h7-8,14,16,18H,4-6,9-13,15H2,1-3H3/p+2/t16-,18+/m1/s1