4-[(3-ethynylphenyl)amino]-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylic acid

Systemtic Name: 4-[(3-ethynylphenyl)amino]-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylic acid Openeye Name: 4-(3-ethynylanilino)-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylic acid CAS Name: 4-(3-ethynylanilino)-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylic acid IUPAC Name: 4-(3-ethynylanilino)-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylic acid Traditional Name: 4-(3-ethynylanilino)-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylic acid Formula: C15H10N4O2 MolecularWeight: 278.2655

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC2=NC=NC3=C2C(=CN3)C(=O)O

Isomeric SMILES

C#CC1=CC(=CC=C1)NC2=NC=NC3=C2C(=CN3)C(=O)O

InChI

InChI=1S/C15H10N4O2/c1-2-9-4-3-5-10(6-9)19-14-12-11(15(20)21)7-16-13(12)17-8-18-14/h1,3-8H,(H,20,21)(H2,16,17,18,19)