2-[4-(2-azanyl-3-cyano-5-oxidanylidene-4,6,7,8-tetrahydrochromen-4-yl)-2-ethoxy-phenoxy]-N-phenyl-ethanamide

Systemtic Name: 2-[4-(2-azanyl-3-cyano-5-oxidanylidene-4,6,7,8-tetrahydrochromen-4-yl)-2-ethoxy-phenoxy]-N-phenyl-ethanamide Openeye Name: 2-[4-(2-amino-3-cyano-5-oxo-4,6,7,8-tetrahydrochromen-4-yl)-2-ethoxy-phenoxy]-N-phenyl-acetamide CAS Name: 2-[4-(2-amino-3-cyano-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-4-yl)-2-ethoxyphenoxy]-N-phenylacetamide IUPAC Name: 2-[4-(2-amino-3-cyano-5-oxo-4,6,7,8-tetrahydrochromen-4-yl)-2-ethoxyphenoxy]-N-phenylacetamide Traditional Name: 2-[4-(2-amino-3-cyano-5-keto-4,6,7,8-tetrahydrochromen-4-yl)-2-ethoxy-phenoxy]-N-phenyl-acetamide Formula: C26H25N3O5 MolecularWeight: 459.4938

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(=C(OC3=C2C(=O)CCC3)N)C#N)OCC(=O)NC4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2C(=C(OC3=C2C(=O)CCC3)N)C#N)OCC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C26H25N3O5/c1-2-32-22-13-16(11-12-20(22)33-15-23(31)29-17-7-4-3-5-8-17)24-18(14-27)26(28)34-21-10-6-9-19(30)25(21)24/h3-5,7-8,11-13,24H,2,6,9-10,15,28H2,1H3,(H,29,31)