3-(2,5-dimethylpyrrol-1-yl)-5-(4-methoxyphenyl)thiophene-2-carboxylic acid

Systemtic Name: 3-(2,5-dimethylpyrrol-1-yl)-5-(4-methoxyphenyl)thiophene-2-carboxylic acid Openeye Name: 3-(2,5-dimethylpyrrol-1-yl)-5-(4-methoxyphenyl)thiophene-2-carboxylic acid CAS Name: 3-(2,5-dimethyl-1-pyrrolyl)-5-(4-methoxyphenyl)-2-thiophenecarboxylic acid IUPAC Name: 3-(2,5-dimethylpyrrol-1-yl)-5-(4-methoxyphenyl)thiophene-2-carboxylic acid Traditional Name: 3-(2,5-dimethylpyrrol-1-yl)-5-(4-methoxyphenyl)-2-thenoic acid Formula: C18H17NO3S MolecularWeight: 327.39748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=C(SC(=C2)C3=CC=C(C=C3)OC)C(=O)O)C

Isomeric SMILES

CC1=CC=C(N1C2=C(SC(=C2)C3=CC=C(C=C3)OC)C(=O)O)C

InChI

InChI=1S/C18H17NO3S/c1-11-4-5-12(2)19(11)15-10-16(23-17(15)18(20)21)13-6-8-14(22-3)9-7-13/h4-10H,1-3H3,(H,20,21)