2-[(Z)-1-chloranyl-2-(3,4,5-trimethoxyphenyl)ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: 2-[(Z)-1-chloranyl-2-(3,4,5-trimethoxyphenyl)ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: 2-[(Z)-1-chloro-2-(3,4,5-trimethoxyphenyl)vinyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[(Z)-1-chloro-2-(3,4,5-trimethoxyphenyl)ethenyl]-4-oxo-1H-quinazoline-7-carboxylate IUPAC Name: 2-[(Z)-1-chloro-2-(3,4,5-trimethoxyphenyl)ethenyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[(Z)-1-chloro-2-(3,4,5-trimethoxyphenyl)vinyl]-4-keto-1H-quinazoline-7-carboxylate Formula: C20H16ClN2O6- MolecularWeight: 415.80384

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=C(C2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)[O-])Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)/C=C(/C2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)[O-])\Cl

InChI

InChI=1S/C20H17ClN2O6/c1-27-15-7-10(8-16(28-2)17(15)29-3)6-13(21)18-22-14-9-11(20(25)26)4-5-12(14)19(24)23-18/h4-9H,1-3H3,(H,25,26)(H,22,23,24)/p-1/b13-6-