3-[1-[2-(3,4-dimethoxyphenyl)ethanoyl]piperidin-4-yl]-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one

Systemtic Name: 3-[1-[2-(3,4-dimethoxyphenyl)ethanoyl]piperidin-4-yl]-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one Openeye Name: 3-[1-[2-(3,4-dimethoxyphenyl)acetyl]-4-piperidyl]-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one CAS Name: 3-[1-[2-(3,4-dimethoxyphenyl)-1-oxoethyl]-4-piperidinyl]-1-(4-ethyl-1-piperazin-4-iumyl)-1-propanone IUPAC Name: 3-[1-[2-(3,4-dimethoxyphenyl)acetyl]piperidin-4-yl]-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one Traditional Name: 1-(4-ethylpiperazin-4-ium-1-yl)-3-(1-homoveratroyl-4-piperidyl)propan-1-one Formula: C24H38N3O4+ MolecularWeight: 432.57622

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)CCC2CCN(CC2)C(=O)CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)CCC2CCN(CC2)C(=O)CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C24H37N3O4/c1-4-25-13-15-27(16-14-25)23(28)8-6-19-9-11-26(12-10-19)24(29)18-20-5-7-21(30-2)22(17-20)31-3/h5,7,17,19H,4,6,8-16,18H2,1-3H3/p+1