methyl (2E)-2-[(2E)-2-(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-1-chloranyl-ethylidene]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl (2E)-2-[(2E)-2-(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-1-chloranyl-ethylidene]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl (2E)-2-[(2E)-2-(3-bromo-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-1-chloro-ethylidene]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: (2E)-2-[(2E)-2-(3-bromo-5-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)-1-chloroethylidene]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl (2E)-2-[(2E)-2-(3-bromo-5-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)-1-chloroethylidene]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: (2E)-2-[(2E)-2-(3-bromo-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)-1-chloro-ethylidene]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C19H14BrClN2O5 MolecularWeight: 465.68186

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C2NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2)Cl)C=C(C1=O)Br

Isomeric SMILES

COC1=C/C(=C\C(=C/2\NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2)\Cl)/C=C(C1=O)Br

InChI

InChI=1S/C19H14BrClN2O5/c1-27-15-7-9(5-12(20)16(15)24)6-13(21)17-22-14-8-10(19(26)28-2)3-4-11(14)18(25)23-17/h3-8,22H,1-2H3,(H,23,25)/b9-6-,17-13+