methyl 4-[3-[(3E)-3-[(3-methoxy-1H-pyrrol-2-yl)methylidene]-2-oxidanylidene-1H-indol-4-yl]-1-oxidanyl-prop-2-ynyl]benzoate

Systemtic Name: methyl 4-[3-[(3E)-3-[(3-methoxy-1H-pyrrol-2-yl)methylidene]-2-oxidanylidene-1H-indol-4-yl]-1-oxidanyl-prop-2-ynyl]benzoate Openeye Name: methyl 4-[1-hydroxy-3-[(3E)-3-[(3-methoxy-1H-pyrrol-2-yl)methylene]-2-oxo-indolin-4-yl]prop-2-ynyl]benzoate CAS Name: 4-[1-hydroxy-3-[(3E)-3-[(3-methoxy-1H-pyrrol-2-yl)methylidene]-2-oxo-1H-indol-4-yl]prop-2-ynyl]benzoic acid methyl ester IUPAC Name: methyl 4-[1-hydroxy-3-[(3E)-3-[(3-methoxy-1H-pyrrol-2-yl)methylidene]-2-oxo-1H-indol-4-yl]prop-2-ynyl]benzoate Traditional Name: 4-[1-hydroxy-3-[(3E)-2-keto-3-[(3-methoxy-1H-pyrrol-2-yl)methylene]indolin-4-yl]prop-2-ynyl]benzoic acid methyl ester Formula: C25H20N2O5 MolecularWeight: 428.4367

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(NC=C1)C=C2C3=C(C=CC=C3NC2=O)C#CC(C4=CC=C(C=C4)C(=O)OC)O

Isomeric SMILES

COC1=C(NC=C1)/C=C/2\C3=C(C=CC=C3NC2=O)C#CC(C4=CC=C(C=C4)C(=O)OC)O

InChI

InChI=1S/C25H20N2O5/c1-31-22-12-13-26-20(22)14-18-23-16(4-3-5-19(23)27-24(18)29)10-11-21(28)15-6-8-17(9-7-15)25(30)32-2/h3-9,12-14,21,26,28H,1-2H3,(H,27,29)/b18-14+