[4-(4-cyanophenyl)phenyl] 2-oxidanylidene-7-propoxy-chromene-3-carboxylate

Systemtic Name: [4-(4-cyanophenyl)phenyl] 2-oxidanylidene-7-propoxy-chromene-3-carboxylate Openeye Name: [4-(4-cyanophenyl)phenyl] 2-oxo-7-propoxy-chromene-3-carboxylate CAS Name: 2-oxo-7-propoxy-1-benzopyran-3-carboxylic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 2-oxo-7-propoxychromene-3-carboxylate Traditional Name: 2-keto-7-propoxy-chromene-3-carboxylic acid [4-(4-cyanophenyl)phenyl] ester Formula: C26H19NO5 MolecularWeight: 425.43276

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

Isomeric SMILES

CCCOC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C26H19NO5/c1-2-13-30-22-12-9-20-14-23(26(29)32-24(20)15-22)25(28)31-21-10-7-19(8-11-21)18-5-3-17(16-27)4-6-18/h3-12,14-15H,2,13H2,1H3