2-(1,3-benzodioxol-5-yl)-1-[2-(2,3,4-trimethoxyphenyl)carbonylpyrazolidin-1-yl]ethanone

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-1-[2-(2,3,4-trimethoxyphenyl)carbonylpyrazolidin-1-yl]ethanone Openeye Name: 2-(1,3-benzodioxol-5-yl)-1-[2-(2,3,4-trimethoxybenzoyl)pyrazolidin-1-yl]ethanone CAS Name: 2-(1,3-benzodioxol-5-yl)-1-[2-[oxo-(2,3,4-trimethoxyphenyl)methyl]-1-pyrazolidinyl]ethanone IUPAC Name: 2-(1,3-benzodioxol-5-yl)-1-[2-(2,3,4-trimethoxybenzoyl)pyrazolidin-1-yl]ethanone Traditional Name: 2-(1,3-benzodioxol-5-yl)-1-[2-(2,3,4-trimethoxybenzoyl)pyrazolidin-1-yl]ethanone Formula: C22H24N2O7 MolecularWeight: 428.43516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C(=O)N2CCCN2C(=O)CC3=CC4=C(C=C3)OCO4)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C(=O)N2CCCN2C(=O)CC3=CC4=C(C=C3)OCO4)OC)OC

InChI

InChI=1S/C22H24N2O7/c1-27-17-8-6-15(20(28-2)21(17)29-3)22(26)24-10-4-9-23(24)19(25)12-14-5-7-16-18(11-14)31-13-30-16/h5-8,11H,4,9-10,12-13H2,1-3H3