5-(3-methanoyl-2,5-dimethyl-pyrrol-1-yl)benzene-1,3-dicarboxylate

Systemtic Name: 5-(3-methanoyl-2,5-dimethyl-pyrrol-1-yl)benzene-1,3-dicarboxylate Openeye Name: 5-(3-formyl-2,5-dimethyl-pyrrol-1-yl)benzene-1,3-dicarboxylate CAS Name: 5-(3-formyl-2,5-dimethyl-1-pyrrolyl)benzene-1,3-dicarboxylate IUPAC Name: 5-(3-formyl-2,5-dimethylpyrrol-1-yl)benzene-1,3-dicarboxylate Traditional Name: 5-(3-formyl-2,5-dimethyl-pyrrol-1-yl)isophthalate Formula: C15H11NO5-2 MolecularWeight: 285.25154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC(=C2)C(=O)[O-])C(=O)[O-])C)C=O

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC(=C2)C(=O)[O-])C(=O)[O-])C)C=O

InChI

InChI=1S/C15H13NO5/c1-8-3-12(7-17)9(2)16(8)13-5-10(14(18)19)4-11(6-13)15(20)21/h3-7H,1-2H3,(H,18,19)(H,20,21)/p-2