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

Systemtic Name: 2-azanyl-4-[4-[(2-cyanophenyl)methoxy]-3-iodanyl-phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile Openeye Name: 2-amino-4-[4-[(2-cyanophenyl)methoxy]-3-iodo-phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile CAS Name: 2-amino-4-[4-[(2-cyanophenyl)methoxy]-3-iodophenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-[4-[(2-cyanophenyl)methoxy]-3-iodophenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile Traditional Name: 2-amino-4-[4-(2-cyanobenzyl)oxy-3-iodo-phenyl]-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carbonitrile Formula: C26H22IN3O3 MolecularWeight: 551.37565

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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)OCC4=CC=CC=C4C#N)I)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)OCC4=CC=CC=C4C#N)I)C(=O)C1)C

InChI

InChI=1S/C26H22IN3O3/c1-26(2)10-20(31)24-22(11-26)33-25(30)18(13-29)23(24)15-7-8-21(19(27)9-15)32-14-17-6-4-3-5-16(17)12-28/h3-9,23H,10-11,14,30H2,1-2H3