2-(3-ethoxycarbonyl-1-ethyl-4-methyl-pyrrol-2-yl)ethanoic acid

Systemtic Name: 2-(3-ethoxycarbonyl-1-ethyl-4-methyl-pyrrol-2-yl)ethanoic acid Openeye Name: 2-(3-ethoxycarbonyl-1-ethyl-4-methyl-pyrrol-2-yl)acetic acid CAS Name: 2-(3-ethoxycarbonyl-1-ethyl-4-methyl-2-pyrrolyl)acetic acid IUPAC Name: 2-(3-ethoxycarbonyl-1-ethyl-4-methylpyrrol-2-yl)acetic acid Traditional Name: 2-(3-carbethoxy-1-ethyl-4-methyl-pyrrol-2-yl)acetic acid Formula: C12H17NO4 MolecularWeight: 239.26768

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=C1CC(=O)O)C(=O)OCC)C

Isomeric SMILES

CCN1C=C(C(=C1CC(=O)O)C(=O)OCC)C

InChI

InChI=1S/C12H17NO4/c1-4-13-7-8(3)11(12(16)17-5-2)9(13)6-10(14)15/h7H,4-6H2,1-3H3,(H,14,15)