methyl 3-[2-(hydroxymethyl)pyrrol-1-yl]-4-oxidanyl-benzoate

Systemtic Name: methyl 3-[2-(hydroxymethyl)pyrrol-1-yl]-4-oxidanyl-benzoate Openeye Name: methyl 4-hydroxy-3-[2-(hydroxymethyl)pyrrol-1-yl]benzoate CAS Name: 4-hydroxy-3-[2-(hydroxymethyl)-1-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 4-hydroxy-3-[2-(hydroxymethyl)pyrrol-1-yl]benzoate Traditional Name: 4-hydroxy-3-(2-methylolpyrrol-1-yl)benzoic acid methyl ester Formula: C13H13NO4 MolecularWeight: 247.24662

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)O)N2C=CC=C2CO

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)O)N2C=CC=C2CO

InChI

InChI=1S/C13H13NO4/c1-18-13(17)9-4-5-12(16)11(7-9)14-6-2-3-10(14)8-15/h2-7,15-16H,8H2,1H3