4-[(3-carboxy-4-phenyl-phenyl)methyl]-1H-pyrrolo[2,3-b]pyridine-6-carboxylic acid

Systemtic Name: 4-[(3-carboxy-4-phenyl-phenyl)methyl]-1H-pyrrolo[2,3-b]pyridine-6-carboxylic acid Openeye Name: 4-[(3-carboxy-4-phenyl-phenyl)methyl]-1H-pyrrolo[2,3-b]pyridine-6-carboxylic acid CAS Name: 4-[(3-carboxy-4-phenylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine-6-carboxylic acid IUPAC Name: 4-[(3-carboxy-4-phenylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine-6-carboxylic acid Traditional Name: 4-(3-carboxy-4-phenyl-benzyl)-1H-pyrrolo[2,3-b]pyridine-6-carboxylic acid Formula: C22H16N2O4 MolecularWeight: 372.37344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=C(C=C2)CC3=CC(=NC4=C3C=CN4)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=C(C=C2)CC3=CC(=NC4=C3C=CN4)C(=O)O)C(=O)O

InChI

InChI=1S/C22H16N2O4/c25-21(26)18-11-13(6-7-16(18)14-4-2-1-3-5-14)10-15-12-19(22(27)28)24-20-17(15)8-9-23-20/h1-9,11-12H,10H2,(H,23,24)(H,25,26)(H,27,28)