[4-[(2-chloranyl-6,7-dimethoxy-quinazolin-4-yl)amino]phenyl]arsonic acid

Systemtic Name: [4-[(2-chloranyl-6,7-dimethoxy-quinazolin-4-yl)amino]phenyl]arsonic acid Openeye Name: [4-[(2-chloro-6,7-dimethoxy-quinazolin-4-yl)amino]phenyl]arsonic acid CAS Name: [4-[(2-chloro-6,7-dimethoxy-4-quinazolinyl)amino]phenyl]arsonic acid IUPAC Name: [4-[(2-chloro-6,7-dimethoxyquinazolin-4-yl)amino]phenyl]arsonic acid Traditional Name: [4-[(2-chloro-6,7-dimethoxy-quinazolin-4-yl)amino]phenyl]arsonic acid Formula: C16H15AsClN3O5 MolecularWeight: 439.682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)Cl)NC3=CC=C(C=C3)[As](=O)(O)O)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)Cl)NC3=CC=C(C=C3)[As](=O)(O)O)OC

InChI

InChI=1S/C16H15AsClN3O5/c1-25-13-7-11-12(8-14(13)26-2)20-16(18)21-15(11)19-10-5-3-9(4-6-10)17(22,23)24/h3-8H,1-2H3,(H,19,20,21)(H2,22,23,24)