2-(2-methyl-4-oxidanylidene-quinazolin-3-yl)ethyl 2-chloranyl-5-nitro-benzoate

Systemtic Name: 2-(2-methyl-4-oxidanylidene-quinazolin-3-yl)ethyl 2-chloranyl-5-nitro-benzoate Openeye Name: 2-(2-methyl-4-oxo-quinazolin-3-yl)ethyl 2-chloro-5-nitro-benzoate CAS Name: 2-chloro-5-nitrobenzoic acid 2-(2-methyl-4-oxo-3-quinazolinyl)ethyl ester IUPAC Name: 2-(2-methyl-4-oxoquinazolin-3-yl)ethyl 2-chloro-5-nitrobenzoate Traditional Name: 2-chloro-5-nitro-benzoic acid 2-(4-keto-2-methyl-quinazolin-3-yl)ethyl ester Formula: C18H14ClN3O5 MolecularWeight: 387.77386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1CCOC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1CCOC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H14ClN3O5/c1-11-20-16-5-3-2-4-13(16)17(23)21(11)8-9-27-18(24)14-10-12(22(25)26)6-7-15(14)19/h2-7,10H,8-9H2,1H3