4-[(3-chlorophenyl)amino]-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid

Systemtic Name: 4-[(3-chlorophenyl)amino]-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 4-(3-chloroanilino)-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 4-(3-chloroanilino)-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid IUPAC Name: 4-(3-chloroanilino)-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 4-(3-chloroanilino)-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid Formula: C13H9ClN4O2 MolecularWeight: 288.68916

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NC2=NC=NC3=C2C=C(N3)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NC2=NC=NC3=C2C=C(N3)C(=O)O

InChI

InChI=1S/C13H9ClN4O2/c14-7-2-1-3-8(4-7)17-11-9-5-10(13(19)20)18-12(9)16-6-15-11/h1-6H,(H,19,20)(H2,15,16,17,18)