ethyl 5-(4-chlorophenyl)-2-(3-methanoyl-2,5-dimethyl-pyrrol-1-yl)thiophene-3-carboxylate

Systemtic Name: ethyl 5-(4-chlorophenyl)-2-(3-methanoyl-2,5-dimethyl-pyrrol-1-yl)thiophene-3-carboxylate Openeye Name: ethyl 5-(4-chlorophenyl)-2-(3-formyl-2,5-dimethyl-pyrrol-1-yl)thiophene-3-carboxylate CAS Name: 5-(4-chlorophenyl)-2-(3-formyl-2,5-dimethyl-1-pyrrolyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-chlorophenyl)-2-(3-formyl-2,5-dimethylpyrrol-1-yl)thiophene-3-carboxylate Traditional Name: 5-(4-chlorophenyl)-2-(3-formyl-2,5-dimethyl-pyrrol-1-yl)thiophene-3-carboxylic acid ethyl ester Formula: C20H18ClNO3S MolecularWeight: 387.87982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=C(C=C2)Cl)N3C(=CC(=C3C)C=O)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=C(C=C2)Cl)N3C(=CC(=C3C)C=O)C

InChI

InChI=1S/C20H18ClNO3S/c1-4-25-20(24)17-10-18(14-5-7-16(21)8-6-14)26-19(17)22-12(2)9-15(11-23)13(22)3/h5-11H,4H2,1-3H3