methyl 3-(hydroxymethyl)-5-pyrrol-1-yl-benzoate

Systemtic Name: methyl 3-(hydroxymethyl)-5-pyrrol-1-yl-benzoate Openeye Name: methyl 3-(hydroxymethyl)-5-pyrrol-1-yl-benzoate CAS Name: 3-(hydroxymethyl)-5-(1-pyrrolyl)benzoic acid methyl ester IUPAC Name: methyl 3-(hydroxymethyl)-5-pyrrol-1-ylbenzoate Traditional Name: 3-methylol-5-pyrrol-1-yl-benzoic acid methyl ester Formula: C13H13NO3 MolecularWeight: 231.24722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13NO3/c1-17-13(16)11-6-10(9-15)7-12(8-11)14-4-2-3-5-14/h2-8,15H,9H2,1H3