5-[3,6-bis(azanyl)-5-(4-carboxyphenyl)pyrazin-2-yl]pyridine-2-carboxylic acid

Systemtic Name: 5-[3,6-bis(azanyl)-5-(4-carboxyphenyl)pyrazin-2-yl]pyridine-2-carboxylic acid Openeye Name: 5-[3,6-diamino-5-(4-carboxyphenyl)pyrazin-2-yl]pyridine-2-carboxylic acid CAS Name: 5-[3,6-diamino-5-(4-carboxyphenyl)-2-pyrazinyl]-2-pyridinecarboxylic acid IUPAC Name: 5-[3,6-diamino-5-(4-carboxyphenyl)pyrazin-2-yl]pyridine-2-carboxylic acid Traditional Name: 5-[3,6-diamino-5-(4-carboxyphenyl)pyrazin-2-yl]picolinic acid Formula: C17H13N5O4 MolecularWeight: 351.31622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(N=C(C(=N2)N)C3=CN=C(C=C3)C(=O)O)N)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C2=C(N=C(C(=N2)N)C3=CN=C(C=C3)C(=O)O)N)C(=O)O

InChI

InChI=1S/C17H13N5O4/c18-14-12(8-1-3-9(4-2-8)16(23)24)21-15(19)13(22-14)10-5-6-11(17(25)26)20-7-10/h1-7H,(H2,18,22)(H2,19,21)(H,23,24)(H,25,26)