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

Systemtic Name: (4S)-2-azanyl-7,7-dimethyl-4-(4-morpholin-4-yl-3-nitro-phenyl)-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile Openeye Name: (4S)-2-amino-7,7-dimethyl-4-(4-morpholino-3-nitro-phenyl)-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile CAS Name: (4S)-2-amino-7,7-dimethyl-4-[4-(4-morpholinyl)-3-nitrophenyl]-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carbonitrile IUPAC Name: (4S)-2-amino-7,7-dimethyl-4-(4-morpholin-4-yl-3-nitrophenyl)-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile Traditional Name: (4S)-2-amino-5-keto-7,7-dimethyl-4-(4-morpholino-3-nitro-phenyl)-6,8-dihydro-4H-chromene-3-carbonitrile Formula: C22H24N4O5 MolecularWeight: 424.44976

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-])C(=O)C1)C

Isomeric SMILES

CC1(CC2=C([C@H](C(=C(O2)N)C#N)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-])C(=O)C1)C

InChI

InChI=1S/C22H24N4O5/c1-22(2)10-17(27)20-18(11-22)31-21(24)14(12-23)19(20)13-3-4-15(16(9-13)26(28)29)25-5-7-30-8-6-25/h3-4,9,19H,5-8,10-11,24H2,1-2H3/t19-/m0/s1