[4-[(2-cyano-4-oxidanylidene-chromen-7-yl)oxymethyl]-2-(quinolin-2-ylmethoxy)phenyl] benzoate

Systemtic Name: [4-[(2-cyano-4-oxidanylidene-chromen-7-yl)oxymethyl]-2-(quinolin-2-ylmethoxy)phenyl] benzoate Openeye Name: [4-[(2-cyano-4-oxo-chromen-7-yl)oxymethyl]-2-(2-quinolylmethoxy)phenyl] benzoate CAS Name: benzoic acid [4-[(2-cyano-4-oxo-1-benzopyran-7-yl)oxymethyl]-2-(2-quinolinylmethoxy)phenyl] ester IUPAC Name: [4-[(2-cyano-4-oxochromen-7-yl)oxymethyl]-2-(quinolin-2-ylmethoxy)phenyl] benzoate Traditional Name: benzoic acid [4-[(2-cyano-4-keto-chromen-7-yl)oxymethyl]-2-(2-quinolylmethoxy)phenyl] ester Formula: C34H22N2O6 MolecularWeight: 554.54828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)COC3=CC4=C(C=C3)C(=O)C=C(O4)C#N)OCC5=NC6=CC=CC=C6C=C5

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)COC3=CC4=C(C=C3)C(=O)C=C(O4)C#N)OCC5=NC6=CC=CC=C6C=C5

InChI

InChI=1S/C34H22N2O6/c35-19-27-17-30(37)28-14-13-26(18-32(28)41-27)39-20-22-10-15-31(42-34(38)24-7-2-1-3-8-24)33(16-22)40-21-25-12-11-23-6-4-5-9-29(23)36-25/h1-18H,20-21H2