2-[3,5-bis(ethoxycarbonyl)-2-ethyl-4-methyl-pyrrol-2-yl]ethanoic acid

Systemtic Name: 2-[3,5-bis(ethoxycarbonyl)-2-ethyl-4-methyl-pyrrol-2-yl]ethanoic acid Openeye Name: 2-[3,5-bis(ethoxycarbonyl)-2-ethyl-4-methyl-pyrrol-2-yl]acetic acid CAS Name: 2-[3,5-bis(ethoxycarbonyl)-2-ethyl-4-methyl-2-pyrrolyl]acetic acid IUPAC Name: 2-[3,5-bis(ethoxycarbonyl)-2-ethyl-4-methylpyrrol-2-yl]acetic acid Traditional Name: 2-(3,5-dicarbethoxy-2-ethyl-4-methyl-pyrrol-2-yl)acetic acid Formula: C15H21NO6 MolecularWeight: 311.33034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=C(C(=N1)C(=O)OCC)C)C(=O)OCC)CC(=O)O

Isomeric SMILES

CCC1(C(=C(C(=N1)C(=O)OCC)C)C(=O)OCC)CC(=O)O

InChI

InChI=1S/C15H21NO6/c1-5-15(8-10(17)18)11(13(19)21-6-2)9(4)12(16-15)14(20)22-7-3/h5-8H2,1-4H3,(H,17,18)