2-(3-ethoxycarbonyl-2-ethyl-4,5-dimethyl-pyrrol-2-yl)ethanoic acid

Systemtic Name: 2-(3-ethoxycarbonyl-2-ethyl-4,5-dimethyl-pyrrol-2-yl)ethanoic acid Openeye Name: 2-(3-ethoxycarbonyl-2-ethyl-4,5-dimethyl-pyrrol-2-yl)acetic acid CAS Name: 2-(3-ethoxycarbonyl-2-ethyl-4,5-dimethyl-2-pyrrolyl)acetic acid IUPAC Name: 2-(3-ethoxycarbonyl-2-ethyl-4,5-dimethylpyrrol-2-yl)acetic acid Traditional Name: 2-(3-carbethoxy-2-ethyl-4,5-dimethyl-pyrrol-2-yl)acetic acid Formula: C13H19NO4 MolecularWeight: 253.29426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19NO4/c1-5-13(7-10(15)16)11(12(17)18-6-2)8(3)9(4)14-13/h5-7H2,1-4H3,(H,15,16)