1-[2,6-dimethyl-4-(3-morpholin-4-ylpropoxy)phenyl]-6-nitro-3,4-dihydroquinazolin-2-one

Systemtic Name: 1-[2,6-dimethyl-4-(3-morpholin-4-ylpropoxy)phenyl]-6-nitro-3,4-dihydroquinazolin-2-one Openeye Name: 1-[2,6-dimethyl-4-(3-morpholinopropoxy)phenyl]-6-nitro-3,4-dihydroquinazolin-2-one CAS Name: 1-[2,6-dimethyl-4-[3-(4-morpholinyl)propoxy]phenyl]-6-nitro-3,4-dihydroquinazolin-2-one IUPAC Name: 1-[2,6-dimethyl-4-(3-morpholin-4-ylpropoxy)phenyl]-6-nitro-3,4-dihydroquinazolin-2-one Traditional Name: 1-[2,6-dimethyl-4-(3-morpholinopropoxy)phenyl]-6-nitro-3,4-dihydroquinazolin-2-one Formula: C23H28N4O5 MolecularWeight: 440.49222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1N2C3=C(CNC2=O)C=C(C=C3)[N+](=O)[O-])C)OCCCN4CCOCC4

Isomeric SMILES

CC1=CC(=CC(=C1N2C3=C(CNC2=O)C=C(C=C3)[N+](=O)[O-])C)OCCCN4CCOCC4

InChI

InChI=1S/C23H28N4O5/c1-16-12-20(32-9-3-6-25-7-10-31-11-8-25)13-17(2)22(16)26-21-5-4-19(27(29)30)14-18(21)15-24-23(26)28/h4-5,12-14H,3,6-11,15H2,1-2H3,(H,24,28)