1-methyl-3-phenylmethoxy-pyrrole-2,4-dicarboxylic acid

Systemtic Name: 1-methyl-3-phenylmethoxy-pyrrole-2,4-dicarboxylic acid Openeye Name: 3-benzyloxy-1-methyl-pyrrole-2,4-dicarboxylic acid CAS Name: 1-methyl-3-phenylmethoxypyrrole-2,4-dicarboxylic acid IUPAC Name: 1-methyl-3-phenylmethoxypyrrole-2,4-dicarboxylic acid Traditional Name: 3-benzoxy-1-methyl-pyrrole-2,4-dicarboxylic acid Formula: C14H13NO5 MolecularWeight: 275.25672

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=C1C(=O)O)OCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CN1C=C(C(=C1C(=O)O)OCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C14H13NO5/c1-15-7-10(13(16)17)12(11(15)14(18)19)20-8-9-5-3-2-4-6-9/h2-7H,8H2,1H3,(H,16,17)(H,18,19)