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

Systemtic Name: ethyl 3-[3-(hydroxymethyl)-2,5-dimethyl-pyrrol-1-yl]benzoate Openeye Name: ethyl 3-[3-(hydroxymethyl)-2,5-dimethyl-pyrrol-1-yl]benzoate CAS Name: 3-[3-(hydroxymethyl)-2,5-dimethyl-1-pyrrolyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-[3-(hydroxymethyl)-2,5-dimethylpyrrol-1-yl]benzoate Traditional Name: 3-(2,5-dimethyl-3-methylol-pyrrol-1-yl)benzoic acid ethyl ester Formula: C16H19NO3 MolecularWeight: 273.32696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)N2C(=CC(=C2C)CO)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)N2C(=CC(=C2C)CO)C

InChI

InChI=1S/C16H19NO3/c1-4-20-16(19)13-6-5-7-15(9-13)17-11(2)8-14(10-18)12(17)3/h5-9,18H,4,10H2,1-3H3