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

Systemtic Name: ethyl 2-azanyl-4-[3-(trifluoromethyl)phenyl]-4H-benzo[h]chromene-3-carboxylate Openeye Name: ethyl 2-amino-4-[3-(trifluoromethyl)phenyl]-4H-benzo[h]chromene-3-carboxylate CAS Name: 2-amino-4-[3-(trifluoromethyl)phenyl]-4H-benzo[h][1]benzopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-[3-(trifluoromethyl)phenyl]-4H-benzo[h]chromene-3-carboxylate Traditional Name: 2-amino-4-[3-(trifluoromethyl)phenyl]-4H-benzo[h]chromene-3-carboxylic acid ethyl ester Formula: C23H18F3NO3 MolecularWeight: 413.38913

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C(C1C3=CC(=CC=C3)C(F)(F)F)C=CC4=CC=CC=C42)N

Isomeric SMILES

CCOC(=O)C1=C(OC2=C(C1C3=CC(=CC=C3)C(F)(F)F)C=CC4=CC=CC=C42)N

InChI

InChI=1S/C23H18F3NO3/c1-2-29-22(28)19-18(14-7-5-8-15(12-14)23(24,25)26)17-11-10-13-6-3-4-9-16(13)20(17)30-21(19)27/h3-12,18H,2,27H2,1H3