[1-[2-(3,4-dimethoxyphenyl)ethanoyl]piperidin-4-yl]azanium

Systemtic Name: [1-[2-(3,4-dimethoxyphenyl)ethanoyl]piperidin-4-yl]azanium Openeye Name: [1-[2-(3,4-dimethoxyphenyl)acetyl]-4-piperidyl]ammonium CAS Name: [1-[2-(3,4-dimethoxyphenyl)-1-oxoethyl]-4-piperidinyl]ammonium IUPAC Name: [1-[2-(3,4-dimethoxyphenyl)acetyl]piperidin-4-yl]azanium Traditional Name: (1-homoveratroyl-4-piperidyl)ammonium Formula: C15H23N2O3+ MolecularWeight: 279.35472

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)N2CCC(CC2)[NH3+])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)N2CCC(CC2)[NH3+])OC

InChI

InChI=1S/C15H22N2O3/c1-19-13-4-3-11(9-14(13)20-2)10-15(18)17-7-5-12(16)6-8-17/h3-4,9,12H,5-8,10,16H2,1-2H3/p+1