(3,3-dimethyl-2-oxidanylidene-1H-indol-5-yl) 4-(quinolin-2-ylmethoxy)benzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-1H-indol-5-yl) 4-(quinolin-2-ylmethoxy)benzoate Openeye Name: (3,3-dimethyl-2-oxo-indolin-5-yl) 4-(2-quinolylmethoxy)benzoate CAS Name: 4-(2-quinolinylmethoxy)benzoic acid (3,3-dimethyl-2-oxo-1H-indol-5-yl) ester IUPAC Name: (3,3-dimethyl-2-oxo-1H-indol-5-yl) 4-(quinolin-2-ylmethoxy)benzoate Traditional Name: 4-(2-quinolylmethoxy)benzoic acid (2-keto-3,3-dimethyl-indolin-5-yl) ester Formula: C27H22N2O4 MolecularWeight: 438.47458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)OC(=O)C3=CC=C(C=C3)OCC4=NC5=CC=CC=C5C=C4)NC1=O)C

Isomeric SMILES

CC1(C2=C(C=CC(=C2)OC(=O)C3=CC=C(C=C3)OCC4=NC5=CC=CC=C5C=C4)NC1=O)C

InChI

InChI=1S/C27H22N2O4/c1-27(2)22-15-21(13-14-24(22)29-26(27)31)33-25(30)18-8-11-20(12-9-18)32-16-19-10-7-17-5-3-4-6-23(17)28-19/h3-15H,16H2,1-2H3,(H,29,31)