2-[1,3-bis(oxidanylidene)isoindol-2-yl]-5-phenyl-pent-4-ynoic acid

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-5-phenyl-pent-4-ynoic acid Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)-5-phenyl-pent-4-ynoic acid CAS Name: 2-(1,3-dioxo-2-isoindolyl)-5-phenyl-4-pentynoic acid IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)-5-phenylpent-4-ynoic acid Traditional Name: 5-phenyl-2-phthalimido-pent-4-ynoic acid Formula: C19H13NO4 MolecularWeight: 319.31082

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CCC(C(=O)O)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1=CC=C(C=C1)C#CCC(C(=O)O)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C19H13NO4/c21-17-14-10-4-5-11-15(14)18(22)20(17)16(19(23)24)12-6-9-13-7-2-1-3-8-13/h1-5,7-8,10-11,16H,12H2,(H,23,24)