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

Systemtic Name: 4-azanyl-2-(3-iodanyl-5-methoxy-4-oxidanyl-phenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-2H-chromene-3-carbonitrile Openeye Name: 4-amino-2-(4-hydroxy-3-iodo-5-methoxy-phenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-2H-chromene-3-carbonitrile CAS Name: 4-amino-2-(4-hydroxy-3-iodo-5-methoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-2H-1-benzopyran-3-carbonitrile IUPAC Name: 4-amino-2-(4-hydroxy-3-iodo-5-methoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-2H-chromene-3-carbonitrile Traditional Name: 4-amino-2-(4-hydroxy-3-iodo-5-methoxy-phenyl)-5-keto-7,7-dimethyl-6,8-dihydro-2H-chromene-3-carbonitrile Formula: C19H19IN2O4 MolecularWeight: 466.26963

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)C(=C(C(O2)C3=CC(=C(C(=C3)I)O)OC)C#N)N)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)C(=C(C(O2)C3=CC(=C(C(=C3)I)O)OC)C#N)N)C

InChI

InChI=1S/C19H19IN2O4/c1-19(2)6-12(23)15-14(7-19)26-18(10(8-21)16(15)22)9-4-11(20)17(24)13(5-9)25-3/h4-5,18,24H,6-7,22H2,1-3H3