3,5-bis(3,5-dimethoxyphenyl)-1H-pyrrole-2-carboxylic acid

Systemtic Name: 3,5-bis(3,5-dimethoxyphenyl)-1H-pyrrole-2-carboxylic acid Openeye Name: 3,5-bis(3,5-dimethoxyphenyl)-1H-pyrrole-2-carboxylic acid CAS Name: 3,5-bis(3,5-dimethoxyphenyl)-1H-pyrrole-2-carboxylic acid IUPAC Name: 3,5-bis(3,5-dimethoxyphenyl)-1H-pyrrole-2-carboxylic acid Traditional Name: 3,5-bis(3,5-dimethoxyphenyl)-1H-pyrrole-2-carboxylic acid Formula: C21H21NO6 MolecularWeight: 383.39454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C2=CC(=C(N2)C(=O)O)C3=CC(=CC(=C3)OC)OC)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C2=CC(=C(N2)C(=O)O)C3=CC(=CC(=C3)OC)OC)OC

InChI

InChI=1S/C21H21NO6/c1-25-14-5-12(6-15(9-14)26-2)18-11-19(22-20(18)21(23)24)13-7-16(27-3)10-17(8-13)28-4/h5-11,22H,1-4H3,(H,23,24)