[(3S)-1-[(3,4-dimethoxyphenyl)methyl]piperidin-1-ium-3-yl]azanium

Systemtic Name: [(3S)-1-[(3,4-dimethoxyphenyl)methyl]piperidin-1-ium-3-yl]azanium Openeye Name: [(3S)-1-[(3,4-dimethoxyphenyl)methyl]piperidin-1-ium-3-yl]ammonium CAS Name: [(3S)-1-[(3,4-dimethoxyphenyl)methyl]-3-piperidin-1-iumyl]ammonium IUPAC Name: [(3S)-1-[(3,4-dimethoxyphenyl)methyl]piperidin-1-ium-3-yl]azanium Traditional Name: [(3S)-1-veratrylpiperidin-1-ium-3-yl]ammonium Formula: C14H24N2O2+2 MolecularWeight: 252.35256

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH+]2CCCC(C2)[NH3+])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH+]2CCC[C@@H](C2)[NH3+])OC

InChI

InChI=1S/C14H22N2O2/c1-17-13-6-5-11(8-14(13)18-2)9-16-7-3-4-12(15)10-16/h5-6,8,12H,3-4,7,9-10,15H2,1-2H3/p+2/t12-/m0/s1