4-azanyl-5-(1,3-benzodioxol-5-yl)-2-methyl-1H-pyrrole-3-carboxylic acid

Systemtic Name: 4-azanyl-5-(1,3-benzodioxol-5-yl)-2-methyl-1H-pyrrole-3-carboxylic acid Openeye Name: 4-amino-5-(1,3-benzodioxol-5-yl)-2-methyl-1H-pyrrole-3-carboxylic acid CAS Name: 4-amino-5-(1,3-benzodioxol-5-yl)-2-methyl-1H-pyrrole-3-carboxylic acid IUPAC Name: 4-amino-5-(1,3-benzodioxol-5-yl)-2-methyl-1H-pyrrole-3-carboxylic acid Traditional Name: 4-amino-5-(1,3-benzodioxol-5-yl)-2-methyl-1H-pyrrole-3-carboxylic acid Formula: C13H12N2O4 MolecularWeight: 260.24538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12N2O4/c1-6-10(13(16)17)11(14)12(15-6)7-2-3-8-9(4-7)19-5-18-8/h2-4,15H,5,14H2,1H3,(H,16,17)