3-[1-(3-methoxycarbonylphenyl)-5-thiophen-2-yl-pyrrol-2-yl]propanoic acid

Systemtic Name: 3-[1-(3-methoxycarbonylphenyl)-5-thiophen-2-yl-pyrrol-2-yl]propanoic acid Openeye Name: 3-[1-(3-methoxycarbonylphenyl)-5-(2-thienyl)pyrrol-2-yl]propanoic acid CAS Name: 3-[1-(3-methoxycarbonylphenyl)-5-thiophen-2-yl-2-pyrrolyl]propanoic acid IUPAC Name: 3-[1-(3-methoxycarbonylphenyl)-5-thiophen-2-ylpyrrol-2-yl]propanoic acid Traditional Name: 3-[1-(3-carbomethoxyphenyl)-5-(2-thienyl)pyrrol-2-yl]propionic acid Formula: C19H17NO4S MolecularWeight: 355.40758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)N2C(=CC=C2C3=CC=CS3)CCC(=O)O

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)N2C(=CC=C2C3=CC=CS3)CCC(=O)O

InChI

InChI=1S/C19H17NO4S/c1-24-19(23)13-4-2-5-15(12-13)20-14(8-10-18(21)22)7-9-16(20)17-6-3-11-25-17/h2-7,9,11-12H,8,10H2,1H3,(H,21,22)