2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl]-4-oxidanylidene-4-[4-[4-(3-oxidanylprop-1-ynyl)phenyl]phenyl]butanoic acid

Systemtic Name: 2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl]-4-oxidanylidene-4-[4-[4-(3-oxidanylprop-1-ynyl)phenyl]phenyl]butanoic acid Openeye Name: 2-[2-(1,3-dioxoisoindolin-2-yl)ethyl]-4-[4-[4-(3-hydroxyprop-1-ynyl)phenyl]phenyl]-4-oxo-butanoic acid CAS Name: 2-[2-(1,3-dioxo-2-isoindolyl)ethyl]-4-[4-[4-(3-hydroxyprop-1-ynyl)phenyl]phenyl]-4-oxobutanoic acid IUPAC Name: 2-[2-(1,3-dioxoisoindol-2-yl)ethyl]-4-[4-[4-(3-hydroxyprop-1-ynyl)phenyl]phenyl]-4-oxobutanoic acid Traditional Name: 4-[4-[4-(3-hydroxyprop-1-ynyl)phenyl]phenyl]-4-keto-2-(2-phthalimidoethyl)butyric acid Formula: C29H23NO6 MolecularWeight: 481.49602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCC(CC(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)C#CCO)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCC(CC(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)C#CCO)C(=O)O

InChI

InChI=1S/C29H23NO6/c31-17-3-4-19-7-9-20(10-8-19)21-11-13-22(14-12-21)26(32)18-23(29(35)36)15-16-30-27(33)24-5-1-2-6-25(24)28(30)34/h1-2,5-14,23,31H,15-18H2,(H,35,36)