methyl 2-[(2-nitrophenyl)carbonyloxymethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[(2-nitrophenyl)carbonyloxymethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[(2-nitrobenzoyl)oxymethyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[(2-nitrophenyl)-oxomethoxy]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[(2-nitrobenzoyl)oxymethyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 4-keto-2-[(2-nitrobenzoyl)oxymethyl]-1H-quinazoline-7-carboxylic acid methyl ester Formula: C18H13N3O7 MolecularWeight: 383.31172

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)COC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)COC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H13N3O7/c1-27-17(23)10-6-7-11-13(8-10)19-15(20-16(11)22)9-28-18(24)12-4-2-3-5-14(12)21(25)26/h2-8H,9H2,1H3,(H,19,20,22)