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

Systemtic Name: 4-azanyl-7,7-dimethyl-2-(5-nitro-2-oxidanyl-phenyl)-5-oxidanylidene-6,8-dihydro-2H-chromene-3-carbonitrile Openeye Name: 4-amino-2-(2-hydroxy-5-nitro-phenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-2H-chromene-3-carbonitrile CAS Name: 4-amino-2-(2-hydroxy-5-nitrophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-2H-1-benzopyran-3-carbonitrile IUPAC Name: 4-amino-2-(2-hydroxy-5-nitrophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-2H-chromene-3-carbonitrile Traditional Name: 4-amino-2-(2-hydroxy-5-nitro-phenyl)-5-keto-7,7-dimethyl-6,8-dihydro-2H-chromene-3-carbonitrile Formula: C18H17N3O5 MolecularWeight: 355.34468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3O5/c1-18(2)6-13(23)15-14(7-18)26-17(11(8-19)16(15)20)10-5-9(21(24)25)3-4-12(10)22/h3-5,17,22H,6-7,20H2,1-2H3