[2-(1H-indol-3-ylmethylidene)-3-oxidanylidene-1-benzofuran-6-yl] 2,2-dimethylpropanoate

Systemtic Name: [2-(1H-indol-3-ylmethylidene)-3-oxidanylidene-1-benzofuran-6-yl] 2,2-dimethylpropanoate Openeye Name: [2-(1H-indol-3-ylmethylene)-3-oxo-benzofuran-6-yl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [2-(1H-indol-3-ylmethylidene)-3-oxo-6-benzofuranyl] ester IUPAC Name: [2-(1H-indol-3-ylmethylidene)-3-oxo-1-benzofuran-6-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [2-(1H-indol-3-ylmethylene)-3-keto-coumaran-6-yl] ester Formula: C22H19NO4 MolecularWeight: 361.39056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1=CC2=C(C=C1)C(=O)C(=CC3=CNC4=CC=CC=C43)O2

Isomeric SMILES

CC(C)(C)C(=O)OC1=CC2=C(C=C1)C(=O)C(=CC3=CNC4=CC=CC=C43)O2

InChI

InChI=1S/C22H19NO4/c1-22(2,3)21(25)26-14-8-9-16-18(11-14)27-19(20(16)24)10-13-12-23-17-7-5-4-6-15(13)17/h4-12,23H,1-3H3