(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-azanyl-3,5-bis(chloranyl)benzoate

Systemtic Name: (7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-azanyl-3,5-bis(chloranyl)benzoate Openeye Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl 2-amino-3,5-dichloro-benzoate CAS Name: 2-amino-3,5-dichlorobenzoic acid (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl 2-amino-3,5-dichlorobenzoate Traditional Name: 2-amino-3,5-dichloro-benzoic acid (7-chloro-4-keto-1H-quinazolin-2-yl)methyl ester Formula: C16H10Cl3N3O3 MolecularWeight: 398.6279

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)NC(=NC2=O)COC(=O)C3=CC(=CC(=C3N)Cl)Cl

Isomeric SMILES

C1=CC2=C(C=C1Cl)NC(=NC2=O)COC(=O)C3=CC(=CC(=C3N)Cl)Cl

InChI

InChI=1S/C16H10Cl3N3O3/c17-7-1-2-9-12(5-7)21-13(22-15(9)23)6-25-16(24)10-3-8(18)4-11(19)14(10)20/h1-5H,6,20H2,(H,21,22,23)