3-methoxycarbonyl-5-pyrrol-1-yl-benzoic acid

Systemtic Name: 3-methoxycarbonyl-5-pyrrol-1-yl-benzoic acid Openeye Name: 3-methoxycarbonyl-5-pyrrol-1-yl-benzoic acid CAS Name: 3-methoxycarbonyl-5-(1-pyrrolyl)benzoic acid IUPAC Name: 3-methoxycarbonyl-5-pyrrol-1-ylbenzoic acid Traditional Name: 3-carbomethoxy-5-pyrrol-1-yl-benzoic acid Formula: C13H11NO4 MolecularWeight: 245.23074

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C(=O)O)N2C=CC=C2

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C(=O)O)N2C=CC=C2

InChI

InChI=1S/C13H11NO4/c1-18-13(17)10-6-9(12(15)16)7-11(8-10)14-4-2-3-5-14/h2-8H,1H3,(H,15,16)