methyl 2-[(Z)-1-chloranyl-2-(4-ethyl-3-nitro-phenyl)ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[(Z)-1-chloranyl-2-(4-ethyl-3-nitro-phenyl)ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[(Z)-1-chloro-2-(4-ethyl-3-nitro-phenyl)vinyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[(Z)-1-chloro-2-(4-ethyl-3-nitrophenyl)ethenyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[(Z)-1-chloro-2-(4-ethyl-3-nitrophenyl)ethenyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[(Z)-1-chloro-2-(4-ethyl-3-nitro-phenyl)vinyl]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C20H16ClN3O5 MolecularWeight: 413.81114

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C=C(C2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC)Cl)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=C(C=C1)/C=C(/C2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC)\Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H16ClN3O5/c1-3-12-5-4-11(9-17(12)24(27)28)8-15(21)18-22-16-10-13(20(26)29-2)6-7-14(16)19(25)23-18/h4-10H,3H2,1-2H3,(H,22,23,25)/b15-8-