methyl 4-[3-(hydroxymethyl)-2,5-dimethyl-pyrrol-1-yl]benzoate

Systemtic Name: methyl 4-[3-(hydroxymethyl)-2,5-dimethyl-pyrrol-1-yl]benzoate Openeye Name: methyl 4-[3-(hydroxymethyl)-2,5-dimethyl-pyrrol-1-yl]benzoate CAS Name: 4-[3-(hydroxymethyl)-2,5-dimethyl-1-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(hydroxymethyl)-2,5-dimethylpyrrol-1-yl]benzoate Traditional Name: 4-(2,5-dimethyl-3-methylol-pyrrol-1-yl)benzoic acid methyl ester Formula: C15H17NO3 MolecularWeight: 259.30038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)OC)C)CO

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)OC)C)CO

InChI

InChI=1S/C15H17NO3/c1-10-8-13(9-17)11(2)16(10)14-6-4-12(5-7-14)15(18)19-3/h4-8,17H,9H2,1-3H3