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

Systemtic Name: (4S)-2-azanyl-4-[4-(dimethylamino)-3-nitro-phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile Openeye Name: (4S)-2-amino-4-[4-(dimethylamino)-3-nitro-phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile CAS Name: (4S)-2-amino-4-[4-(dimethylamino)-3-nitrophenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carbonitrile IUPAC Name: (4S)-2-amino-4-[4-(dimethylamino)-3-nitrophenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile Traditional Name: (4S)-2-amino-4-[4-(dimethylamino)-3-nitro-phenyl]-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carbonitrile Formula: C20H22N4O4 MolecularWeight: 382.41308

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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)N(C)C)[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)N(C)C)[N+](=O)[O-])C(=O)C1)C

InChI

InChI=1S/C20H22N4O4/c1-20(2)8-15(25)18-16(9-20)28-19(22)12(10-21)17(18)11-5-6-13(23(3)4)14(7-11)24(26)27/h5-7,17H,8-9,22H2,1-4H3/t17-/m0/s1