2,7,8-tris(azanyl)-4-(3-iodanyl-4,5-dimethoxy-phenyl)-4H-chromene-3-carbonitrile

Systemtic Name: 2,7,8-tris(azanyl)-4-(3-iodanyl-4,5-dimethoxy-phenyl)-4H-chromene-3-carbonitrile Openeye Name: 2,7,8-triamino-4-(3-iodo-4,5-dimethoxy-phenyl)-4H-chromene-3-carbonitrile CAS Name: 2,7,8-triamino-4-(3-iodo-4,5-dimethoxyphenyl)-4H-1-benzopyran-3-carbonitrile IUPAC Name: 2,7,8-triamino-4-(3-iodo-4,5-dimethoxyphenyl)-4H-chromene-3-carbonitrile Traditional Name: 2,7,8-triamino-4-(3-iodo-4,5-dimethoxy-phenyl)-4H-chromene-3-carbonitrile Formula: C18H17IN4O3 MolecularWeight: 464.25705

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2C3=C(C(=C(C=C3)N)N)OC(=C2C#N)N)I)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C2C3=C(C(=C(C=C3)N)N)OC(=C2C#N)N)I)OC

InChI

InChI=1S/C18H17IN4O3/c1-24-13-6-8(5-11(19)17(13)25-2)14-9-3-4-12(21)15(22)16(9)26-18(23)10(14)7-20/h3-6,14H,21-23H2,1-2H3