(3E)-3-[(3-methoxy-1H-pyrrol-2-yl)methylidene]-4-[3-oxidanyl-3-(4-phenoxyphenyl)prop-1-ynyl]-1H-indol-2-one

Systemtic Name: (3E)-3-[(3-methoxy-1H-pyrrol-2-yl)methylidene]-4-[3-oxidanyl-3-(4-phenoxyphenyl)prop-1-ynyl]-1H-indol-2-one Openeye Name: (3E)-4-[3-hydroxy-3-(4-phenoxyphenyl)prop-1-ynyl]-3-[(3-methoxy-1H-pyrrol-2-yl)methylene]indolin-2-one CAS Name: (3E)-4-[3-hydroxy-3-(4-phenoxyphenyl)prop-1-ynyl]-3-[(3-methoxy-1H-pyrrol-2-yl)methylidene]-1H-indol-2-one IUPAC Name: (3E)-4-[3-hydroxy-3-(4-phenoxyphenyl)prop-1-ynyl]-3-[(3-methoxy-1H-pyrrol-2-yl)methylidene]-1H-indol-2-one Traditional Name: (3E)-4-[3-hydroxy-3-(4-phenoxyphenyl)prop-1-ynyl]-3-[(3-methoxy-1H-pyrrol-2-yl)methylene]oxindole Formula: C29H22N2O4 MolecularWeight: 462.49598

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)OC5=CC=CC=C5)O

Isomeric SMILES

COC1=C(NC=C1)/C=C/2\C3=C(C=CC=C3NC2=O)C#CC(C4=CC=C(C=C4)OC5=CC=CC=C5)O

InChI

InChI=1S/C29H22N2O4/c1-34-27-16-17-30-25(27)18-23-28-20(6-5-9-24(28)31-29(23)33)12-15-26(32)19-10-13-22(14-11-19)35-21-7-3-2-4-8-21/h2-11,13-14,16-18,26,30,32H,1H3,(H,31,33)/b23-18+