N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-(7-nitro-4-oxidanylidene-quinazolin-3-yl)ethanamide

Systemtic Name: N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-(7-nitro-4-oxidanylidene-quinazolin-3-yl)ethanamide Openeye Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-(7-nitro-4-oxo-quinazolin-3-yl)acetamide CAS Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-(7-nitro-4-oxo-3-quinazolinyl)acetamide IUPAC Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-(7-nitro-4-oxoquinazolin-3-yl)acetamide Traditional Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-(4-keto-7-nitro-quinazolin-3-yl)acetamide Formula: C18H15ClN4O5 MolecularWeight: 402.7885

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)CN2C=NC3=C(C2=O)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)CN2C=NC3=C(C2=O)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H15ClN4O5/c1-10-5-15(16(28-2)7-13(10)19)21-17(24)8-22-9-20-14-6-11(23(26)27)3-4-12(14)18(22)25/h3-7,9H,8H2,1-2H3,(H,21,24)