[3-[(Z)-(6-ethoxy-3-oxidanylidene-1-benzofuran-2-ylidene)methyl]phenyl] 4-tert-butylbenzoate

Systemtic Name: [3-[(Z)-(6-ethoxy-3-oxidanylidene-1-benzofuran-2-ylidene)methyl]phenyl] 4-tert-butylbenzoate Openeye Name: [3-[(Z)-(6-ethoxy-3-oxo-benzofuran-2-ylidene)methyl]phenyl] 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid [3-[(Z)-(6-ethoxy-3-oxo-2-benzofuranylidene)methyl]phenyl] ester IUPAC Name: [3-[(Z)-(6-ethoxy-3-oxo-1-benzofuran-2-ylidene)methyl]phenyl] 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid [3-[(Z)-(6-ethoxy-3-keto-coumaran-2-ylidene)methyl]phenyl] ester Formula: C28H26O5 MolecularWeight: 442.50304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)C(=O)C(=CC3=CC(=CC=C3)OC(=O)C4=CC=C(C=C4)C(C)(C)C)O2

Isomeric SMILES

CCOC1=CC2=C(C=C1)C(=O)/C(=C/C3=CC(=CC=C3)OC(=O)C4=CC=C(C=C4)C(C)(C)C)/O2

InChI

InChI=1S/C28H26O5/c1-5-31-21-13-14-23-24(17-21)33-25(26(23)29)16-18-7-6-8-22(15-18)32-27(30)19-9-11-20(12-10-19)28(2,3)4/h6-17H,5H2,1-4H3/b25-16-