2-azanyl-4-(4-chloranyl-3-nitro-phenyl)-7,7-dimethyl-1-morpholin-4-yl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(4-chloranyl-3-nitro-phenyl)-7,7-dimethyl-1-morpholin-4-yl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-4-(4-chloro-3-nitro-phenyl)-7,7-dimethyl-1-morpholino-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-4-(4-chloro-3-nitrophenyl)-7,7-dimethyl-1-(4-morpholinyl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-4-(4-chloro-3-nitrophenyl)-7,7-dimethyl-1-morpholin-4-yl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-4-(4-chloro-3-nitro-phenyl)-5-keto-7,7-dimethyl-1-morpholino-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C22H24ClN5O4 MolecularWeight: 457.91006

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(N2N3CCOCC3)N)C#N)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(N2N3CCOCC3)N)C#N)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C(=O)C1)C

InChI

InChI=1S/C22H24ClN5O4/c1-22(2)10-17-20(18(29)11-22)19(13-3-4-15(23)16(9-13)28(30)31)14(12-24)21(25)27(17)26-5-7-32-8-6-26/h3-4,9,19H,5-8,10-11,25H2,1-2H3