methyl 5-(1,3-benzodioxol-5-yl)-2-methyl-4-oxidanyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-(1,3-benzodioxol-5-yl)-2-methyl-4-oxidanyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-(1,3-benzodioxol-5-yl)-4-hydroxy-2-methyl-1H-pyrrole-3-carboxylate CAS Name: 5-(1,3-benzodioxol-5-yl)-4-hydroxy-2-methyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-(1,3-benzodioxol-5-yl)-4-hydroxy-2-methyl-1H-pyrrole-3-carboxylate Traditional Name: 5-(1,3-benzodioxol-5-yl)-4-hydroxy-2-methyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C14H13NO5 MolecularWeight: 275.25672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)C2=CC3=C(C=C2)OCO3)O)C(=O)OC

Isomeric SMILES

CC1=C(C(=C(N1)C2=CC3=C(C=C2)OCO3)O)C(=O)OC

InChI

InChI=1S/C14H13NO5/c1-7-11(14(17)18-2)13(16)12(15-7)8-3-4-9-10(5-8)20-6-19-9/h3-5,15-16H,6H2,1-2H3