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

Systemtic Name: 5-(3,5-dimethoxyphenyl)carbonyl-1H-pyrrole-3-carboxylic acid Openeye Name: 5-(3,5-dimethoxybenzoyl)-1H-pyrrole-3-carboxylic acid CAS Name: 5-[(3,5-dimethoxyphenyl)-oxomethyl]-1H-pyrrole-3-carboxylic acid IUPAC Name: 5-(3,5-dimethoxybenzoyl)-1H-pyrrole-3-carboxylic acid Traditional Name: 5-(3,5-dimethoxybenzoyl)-1H-pyrrole-3-carboxylic acid Formula: C14H13NO5 MolecularWeight: 275.25672

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)C2=CC(=CN2)C(=O)O)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)C2=CC(=CN2)C(=O)O)OC

InChI

InChI=1S/C14H13NO5/c1-19-10-3-8(4-11(6-10)20-2)13(16)12-5-9(7-15-12)14(17)18/h3-7,15H,1-2H3,(H,17,18)