2-[(2-chloranylquinazolin-4-yl)amino]-4,5-dimethoxy-benzoate

Systemtic Name: 2-[(2-chloranylquinazolin-4-yl)amino]-4,5-dimethoxy-benzoate Openeye Name: 2-[(2-chloroquinazolin-4-yl)amino]-4,5-dimethoxy-benzoate CAS Name: 2-[(2-chloro-4-quinazolinyl)amino]-4,5-dimethoxybenzoate IUPAC Name: 2-[(2-chloroquinazolin-4-yl)amino]-4,5-dimethoxybenzoate Traditional Name: 2-[(2-chloroquinazolin-4-yl)amino]-4,5-dimethoxy-benzoate Formula: C17H13ClN3O4- MolecularWeight: 358.75582

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)[O-])NC2=NC(=NC3=CC=CC=C32)Cl)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)[O-])NC2=NC(=NC3=CC=CC=C32)Cl)OC

InChI

InChI=1S/C17H14ClN3O4/c1-24-13-7-10(16(22)23)12(8-14(13)25-2)19-15-9-5-3-4-6-11(9)20-17(18)21-15/h3-8H,1-2H3,(H,22,23)(H,19,20,21)/p-1