[3-naphthalen-2-yloxy-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 2-nitrobenzoate

Systemtic Name: [3-naphthalen-2-yloxy-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 2-nitrobenzoate Openeye Name: [3-(2-naphthyloxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid [3-(2-naphthalenyloxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [3-naphthalen-2-yloxy-4-oxo-2-(trifluoromethyl)chromen-7-yl] 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid [4-keto-3-(2-naphthoxy)-2-(trifluoromethyl)chromen-7-yl] ester Formula: C27H14F3NO7 MolecularWeight: 521.39777

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)OC3=C(OC4=C(C3=O)C=CC(=C4)OC(=O)C5=CC=CC=C5[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)OC3=C(OC4=C(C3=O)C=CC(=C4)OC(=O)C5=CC=CC=C5[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C27H14F3NO7/c28-27(29,30)25-24(36-17-10-9-15-5-1-2-6-16(15)13-17)23(32)20-12-11-18(14-22(20)38-25)37-26(33)19-7-3-4-8-21(19)31(34)35/h1-14H