4-[2-(furan-2-yl)-1-methyl-pyrrol-3-yl]benzoic acid

Systemtic Name: 4-[2-(furan-2-yl)-1-methyl-pyrrol-3-yl]benzoic acid Openeye Name: 4-[2-(2-furyl)-1-methyl-pyrrol-3-yl]benzoic acid CAS Name: 4-[2-(2-furanyl)-1-methyl-3-pyrrolyl]benzoic acid IUPAC Name: 4-[2-(furan-2-yl)-1-methylpyrrol-3-yl]benzoic acid Traditional Name: 4-[2-(2-furyl)-1-methyl-pyrrol-3-yl]benzoic acid Formula: C16H13NO3 MolecularWeight: 267.27932

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=C1C2=CC=CO2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CN1C=CC(=C1C2=CC=CO2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H13NO3/c1-17-9-8-13(15(17)14-3-2-10-20-14)11-4-6-12(7-5-11)16(18)19/h2-10H,1H3,(H,18,19)