5-ethoxycarbonyl-4-(3-methoxy-3-oxidanylidene-propyl)-2-methyl-1H-pyrrole-3-carboxylic acid

Systemtic Name: 5-ethoxycarbonyl-4-(3-methoxy-3-oxidanylidene-propyl)-2-methyl-1H-pyrrole-3-carboxylic acid Openeye Name: 5-ethoxycarbonyl-4-(3-methoxy-3-oxo-propyl)-2-methyl-1H-pyrrole-3-carboxylic acid CAS Name: 5-ethoxycarbonyl-4-(3-methoxy-3-oxopropyl)-2-methyl-1H-pyrrole-3-carboxylic acid IUPAC Name: 5-ethoxycarbonyl-4-(3-methoxy-3-oxopropyl)-2-methyl-1H-pyrrole-3-carboxylic acid Traditional Name: 5-carbethoxy-4-(3-keto-3-methoxy-propyl)-2-methyl-1H-pyrrole-3-carboxylic acid Formula: C13H17NO6 MolecularWeight: 283.27718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)O)CCC(=O)OC

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)O)CCC(=O)OC

InChI

InChI=1S/C13H17NO6/c1-4-20-13(18)11-8(5-6-9(15)19-3)10(12(16)17)7(2)14-11/h14H,4-6H2,1-3H3,(H,16,17)