methyl 2-chloranyl-6-nitro-4-oxidanylidene-1H-quinazoline-8-carboxylate

Systemtic Name: methyl 2-chloranyl-6-nitro-4-oxidanylidene-1H-quinazoline-8-carboxylate Openeye Name: methyl 2-chloro-6-nitro-4-oxo-1H-quinazoline-8-carboxylate CAS Name: 2-chloro-6-nitro-4-oxo-1H-quinazoline-8-carboxylic acid methyl ester IUPAC Name: methyl 2-chloro-6-nitro-4-oxo-1H-quinazoline-8-carboxylate Traditional Name: 2-chloro-4-keto-6-nitro-1H-quinazoline-8-carboxylic acid methyl ester Formula: C10H6ClN3O5 MolecularWeight: 283.62474

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C(=CC(=C1)[N+](=O)[O-])C(=O)N=C(N2)Cl

Isomeric SMILES

COC(=O)C1=C2C(=CC(=C1)[N+](=O)[O-])C(=O)N=C(N2)Cl

InChI

InChI=1S/C10H6ClN3O5/c1-19-9(16)6-3-4(14(17)18)2-5-7(6)12-10(11)13-8(5)15/h2-3H,1H3,(H,12,13,15)