3-[(4-cyanophenyl)methoxy]-1-methyl-pyrrole-2,4-dicarboxylic acid

Systemtic Name: 3-[(4-cyanophenyl)methoxy]-1-methyl-pyrrole-2,4-dicarboxylic acid Openeye Name: 3-[(4-cyanophenyl)methoxy]-1-methyl-pyrrole-2,4-dicarboxylic acid CAS Name: 3-[(4-cyanophenyl)methoxy]-1-methylpyrrole-2,4-dicarboxylic acid IUPAC Name: 3-[(4-cyanophenyl)methoxy]-1-methylpyrrole-2,4-dicarboxylic acid Traditional Name: 3-(4-cyanobenzyl)oxy-1-methyl-pyrrole-2,4-dicarboxylic acid Formula: C15H12N2O5 MolecularWeight: 300.26618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12N2O5/c1-17-7-11(14(18)19)13(12(17)15(20)21)22-8-10-4-2-9(6-16)3-5-10/h2-5,7H,8H2,1H3,(H,18,19)(H,20,21)