2-azanyl-4-(2,5-diethoxyphenyl)-1-(4-iodophenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(2,5-diethoxyphenyl)-1-(4-iodophenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(2,5-diethoxyphenyl)-1-(4-iodophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(2,5-diethoxyphenyl)-1-(4-iodophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(2,5-diethoxyphenyl)-1-(4-iodophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(2,5-diethoxyphenyl)-1-(4-iodophenyl)-5-keto-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C26H26IN3O3 MolecularWeight: 555.40741

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)OCC)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=C(C=C4)I)N)C#N

Isomeric SMILES

CCOC1=CC(=C(C=C1)OCC)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=C(C=C4)I)N)C#N

InChI

InChI=1S/C26H26IN3O3/c1-3-32-18-12-13-23(33-4-2)19(14-18)24-20(15-28)26(29)30(17-10-8-16(27)9-11-17)21-6-5-7-22(31)25(21)24/h8-14,24H,3-7,29H2,1-2H3