2-azanyl-4-(3-ethoxy-5-iodanyl-4-propan-2-yloxy-phenyl)-7,7-dimethyl-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(3-ethoxy-5-iodanyl-4-propan-2-yloxy-phenyl)-7,7-dimethyl-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(3-ethoxy-5-iodo-4-isopropoxy-phenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(3-ethoxy-5-iodo-4-propan-2-yloxyphenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(3-ethoxy-5-iodo-4-propan-2-yloxyphenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(3-ethoxy-5-iodo-4-isopropoxy-phenyl)-5-keto-7,7-dimethyl-1,4,6,8-tetrahydroquinoline-3-carbonitrile Formula: C23H28IN3O3 MolecularWeight: 521.39119

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C2C(=C(NC3=C2C(=O)CC(C3)(C)C)N)C#N)I)OC(C)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C2C(=C(NC3=C2C(=O)CC(C3)(C)C)N)C#N)I)OC(C)C

InChI

InChI=1S/C23H28IN3O3/c1-6-29-18-8-13(7-15(24)21(18)30-12(2)3)19-14(11-25)22(26)27-16-9-23(4,5)10-17(28)20(16)19/h7-8,12,19,27H,6,9-10,26H2,1-5H3