N-(2-chloranyl-4,6-dimethyl-phenyl)-2-(6-nitro-4-oxidanylidene-quinazolin-3-yl)ethanamide

Systemtic Name: N-(2-chloranyl-4,6-dimethyl-phenyl)-2-(6-nitro-4-oxidanylidene-quinazolin-3-yl)ethanamide Openeye Name: N-(2-chloro-4,6-dimethyl-phenyl)-2-(6-nitro-4-oxo-quinazolin-3-yl)acetamide CAS Name: N-(2-chloro-4,6-dimethylphenyl)-2-(6-nitro-4-oxo-3-quinazolinyl)acetamide IUPAC Name: N-(2-chloro-4,6-dimethylphenyl)-2-(6-nitro-4-oxoquinazolin-3-yl)acetamide Traditional Name: N-(2-chloro-4,6-dimethyl-phenyl)-2-(4-keto-6-nitro-quinazolin-3-yl)acetamide Formula: C18H15ClN4O4 MolecularWeight: 386.7891

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C18H15ClN4O4/c1-10-5-11(2)17(14(19)6-10)21-16(24)8-22-9-20-15-4-3-12(23(26)27)7-13(15)18(22)25/h3-7,9H,8H2,1-2H3,(H,21,24)