methyl 2-[(Z)-1-chloranyl-2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[(Z)-1-chloranyl-2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[(Z)-1-chloro-2-(2,3-dihydro-1,4-benzodioxin-6-yl)vinyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[(Z)-1-chloro-2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethenyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[(Z)-1-chloro-2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethenyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[(Z)-1-chloro-2-(2,3-dihydro-1,4-benzodioxin-6-yl)vinyl]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C20H15ClN2O5 MolecularWeight: 398.7965

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)C(=CC3=CC4=C(C=C3)OCCO4)Cl

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)/C(=C/C3=CC4=C(C=C3)OCCO4)/Cl

InChI

InChI=1S/C20H15ClN2O5/c1-26-20(25)12-3-4-13-15(10-12)22-18(23-19(13)24)14(21)8-11-2-5-16-17(9-11)28-7-6-27-16/h2-5,8-10H,6-7H2,1H3,(H,22,23,24)/b14-8-