2-[(Z)-1-chloranyl-2-[4-(diethylamino)phenyl]ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylic acid

Systemtic Name: 2-[(Z)-1-chloranyl-2-[4-(diethylamino)phenyl]ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylic acid Openeye Name: 2-[(Z)-1-chloro-2-[4-(diethylamino)phenyl]vinyl]-4-oxo-1H-quinazoline-7-carboxylic acid CAS Name: 2-[(Z)-1-chloro-2-[4-(diethylamino)phenyl]ethenyl]-4-oxo-1H-quinazoline-7-carboxylic acid IUPAC Name: 2-[(Z)-1-chloro-2-[4-(diethylamino)phenyl]ethenyl]-4-oxo-1H-quinazoline-7-carboxylic acid Traditional Name: 2-[(Z)-1-chloro-2-[4-(diethylamino)phenyl]vinyl]-4-keto-1H-quinazoline-7-carboxylic acid Formula: C21H20ClN3O3 MolecularWeight: 397.8548

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C=C(C2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)O)Cl

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)/C=C(/C2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)O)\Cl

InChI

InChI=1S/C21H20ClN3O3/c1-3-25(4-2)15-8-5-13(6-9-15)11-17(22)19-23-18-12-14(21(27)28)7-10-16(18)20(26)24-19/h5-12H,3-4H2,1-2H3,(H,27,28)(H,23,24,26)/b17-11-