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

Systemtic Name: (7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 4-(1,2,3,4-tetrazol-1-yl)benzoate Openeye Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl 4-(tetrazol-1-yl)benzoate CAS Name: 4-(1-tetrazolyl)benzoic acid (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl 4-(tetrazol-1-yl)benzoate Traditional Name: 4-(tetrazol-1-yl)benzoic acid (7-chloro-4-keto-1H-quinazolin-2-yl)methyl ester Formula: C17H11ClN6O3 MolecularWeight: 382.76064

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC2=NC(=O)C3=C(N2)C=C(C=C3)Cl)N4C=NN=N4

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCC2=NC(=O)C3=C(N2)C=C(C=C3)Cl)N4C=NN=N4

InChI

InChI=1S/C17H11ClN6O3/c18-11-3-6-13-14(7-11)20-15(21-16(13)25)8-27-17(26)10-1-4-12(5-2-10)24-9-19-22-23-24/h1-7,9H,8H2,(H,20,21,25)