(3-cyano-8-methyl-2-oxidanylidene-1H-quinolin-5-yl) 4-(quinolin-2-ylmethoxy)benzoate

Systemtic Name: (3-cyano-8-methyl-2-oxidanylidene-1H-quinolin-5-yl) 4-(quinolin-2-ylmethoxy)benzoate Openeye Name: (3-cyano-8-methyl-2-oxo-1H-quinolin-5-yl) 4-(2-quinolylmethoxy)benzoate CAS Name: 4-(2-quinolinylmethoxy)benzoic acid (3-cyano-8-methyl-2-oxo-1H-quinolin-5-yl) ester IUPAC Name: (3-cyano-8-methyl-2-oxo-1H-quinolin-5-yl) 4-(quinolin-2-ylmethoxy)benzoate Traditional Name: 4-(2-quinolylmethoxy)benzoic acid (3-cyano-2-keto-8-methyl-1H-quinolin-5-yl) ester Formula: C28H19N3O4 MolecularWeight: 461.46816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)OC(=O)C3=CC=C(C=C3)OCC4=NC5=CC=CC=C5C=C4)C=C(C(=O)N2)C#N

Isomeric SMILES

CC1=C2C(=C(C=C1)OC(=O)C3=CC=C(C=C3)OCC4=NC5=CC=CC=C5C=C4)C=C(C(=O)N2)C#N

InChI

InChI=1S/C28H19N3O4/c1-17-6-13-25(23-14-20(15-29)27(32)31-26(17)23)35-28(33)19-8-11-22(12-9-19)34-16-21-10-7-18-4-2-3-5-24(18)30-21/h2-14H,16H2,1H3,(H,31,32)