2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: 2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: 2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-4-oxo-1H-quinazoline-7-carboxylate IUPAC Name: 2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-4-keto-1H-quinazoline-7-carboxylate Formula: C17H10ClN2O5- MolecularWeight: 357.7247

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C=C2Cl)C3=NC(=O)C4=C(N3)C=C(C=C4)C(=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=C(C=C2Cl)C3=NC(=O)C4=C(N3)C=C(C=C4)C(=O)[O-]

InChI

InChI=1S/C17H11ClN2O5/c18-11-5-9(7-13-14(11)25-4-3-24-13)15-19-12-6-8(17(22)23)1-2-10(12)16(21)20-15/h1-2,5-7H,3-4H2,(H,22,23)(H,19,20,21)/p-1