ethyl 2-azanyl-3-cyano-9-oxidanyl-4-[3-(trifluoromethyl)phenyl]-4H-benzo[h]chromene-8-carboxylate

Systemtic Name: ethyl 2-azanyl-3-cyano-9-oxidanyl-4-[3-(trifluoromethyl)phenyl]-4H-benzo[h]chromene-8-carboxylate Openeye Name: ethyl 2-amino-3-cyano-9-hydroxy-4-[3-(trifluoromethyl)phenyl]-4H-benzo[h]chromene-8-carboxylate CAS Name: 2-amino-3-cyano-9-hydroxy-4-[3-(trifluoromethyl)phenyl]-4H-benzo[h][1]benzopyran-8-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-3-cyano-9-hydroxy-4-[3-(trifluoromethyl)phenyl]-4H-benzo[h]chromene-8-carboxylate Traditional Name: 2-amino-3-cyano-9-hydroxy-4-[3-(trifluoromethyl)phenyl]-4H-benzo[h]chromene-8-carboxylic acid ethyl ester Formula: C24H17F3N2O4 MolecularWeight: 454.39799

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C2C(=C1)C=CC3=C2OC(=C(C3C4=CC(=CC=C4)C(F)(F)F)C#N)N)O

Isomeric SMILES

CCOC(=O)C1=C(C=C2C(=C1)C=CC3=C2OC(=C(C3C4=CC(=CC=C4)C(F)(F)F)C#N)N)O

InChI

InChI=1S/C24H17F3N2O4/c1-2-32-23(31)17-9-12-6-7-15-20(13-4-3-5-14(8-13)24(25,26)27)18(11-28)22(29)33-21(15)16(12)10-19(17)30/h3-10,20,30H,2,29H2,1H3