3-[(2-chloranylquinazolin-4-yl)amino]-4-oxidanyl-benzenesulfonic acid

Systemtic Name: 3-[(2-chloranylquinazolin-4-yl)amino]-4-oxidanyl-benzenesulfonic acid Openeye Name: 3-[(2-chloroquinazolin-4-yl)amino]-4-hydroxy-benzenesulfonic acid CAS Name: 3-[(2-chloro-4-quinazolinyl)amino]-4-hydroxybenzenesulfonic acid IUPAC Name: 3-[(2-chloroquinazolin-4-yl)amino]-4-hydroxybenzenesulfonic acid Traditional Name: 3-[(2-chloroquinazolin-4-yl)amino]-4-hydroxy-besylic acid Formula: C14H10ClN3O4S MolecularWeight: 351.7649

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)Cl)NC3=C(C=CC(=C3)S(=O)(=O)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)Cl)NC3=C(C=CC(=C3)S(=O)(=O)O)O

InChI

InChI=1S/C14H10ClN3O4S/c15-14-17-10-4-2-1-3-9(10)13(18-14)16-11-7-8(23(20,21)22)5-6-12(11)19/h1-7,19H,(H,16,17,18)(H,20,21,22)