N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide

Systemtic Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide Openeye Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-4-(4-oxoquinazolin-3-yl)butanamide CAS Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-4-(4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-4-(4-oxoquinazolin-3-yl)butanamide Traditional Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-4-(4-ketoquinazolin-3-yl)butyramide Formula: C22H24N4O6 MolecularWeight: 440.44916

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)CCCN2C=NC3=CC=CC=C3C2=O)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)CCCN2C=NC3=CC=CC=C3C2=O)[N+](=O)[O-])OC

InChI

InChI=1S/C22H24N4O6/c1-31-19-12-15(18(26(29)30)13-20(19)32-2)9-10-23-21(27)8-5-11-25-14-24-17-7-4-3-6-16(17)22(25)28/h3-4,6-7,12-14H,5,8-11H2,1-2H3,(H,23,27)