(2,2,4-trimethyl-1-naphthalen-1-ylcarbonyl-quinolin-6-yl) 3-fluoranylbenzoate

Systemtic Name: (2,2,4-trimethyl-1-naphthalen-1-ylcarbonyl-quinolin-6-yl) 3-fluoranylbenzoate Openeye Name: [2,2,4-trimethyl-1-(naphthalene-1-carbonyl)-6-quinolyl] 3-fluorobenzoate CAS Name: 3-fluorobenzoic acid [2,2,4-trimethyl-1-[1-naphthalenyl(oxo)methyl]-6-quinolinyl] ester IUPAC Name: [2,2,4-trimethyl-1-(naphthalene-1-carbonyl)quinolin-6-yl] 3-fluorobenzoate Traditional Name: 3-fluorobenzoic acid [2,2,4-trimethyl-1-(1-naphthoyl)-6-quinolyl] ester Formula: C30H24FNO3 MolecularWeight: 465.514863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(N(C2=C1C=C(C=C2)OC(=O)C3=CC(=CC=C3)F)C(=O)C4=CC=CC5=CC=CC=C54)(C)C

Isomeric SMILES

CC1=CC(N(C2=C1C=C(C=C2)OC(=O)C3=CC(=CC=C3)F)C(=O)C4=CC=CC5=CC=CC=C54)(C)C

InChI

InChI=1S/C30H24FNO3/c1-19-18-30(2,3)32(28(33)25-13-7-9-20-8-4-5-12-24(20)25)27-15-14-23(17-26(19)27)35-29(34)21-10-6-11-22(31)16-21/h4-18H,1-3H3