3-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-(4-heptoxyphenyl)propanoic acid

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-(4-heptoxyphenyl)propanoic acid Openeye Name: 3-(1,3-dioxoisoindolin-2-yl)-3-(4-heptoxyphenyl)propanoic acid CAS Name: 3-(1,3-dioxo-2-isoindolyl)-3-(4-heptoxyphenyl)propanoic acid IUPAC Name: 3-(1,3-dioxoisoindol-2-yl)-3-(4-heptoxyphenyl)propanoic acid Traditional Name: 3-(4-heptoxyphenyl)-3-phthalimido-propionic acid Formula: C24H27NO5 MolecularWeight: 409.47488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(CC(=O)O)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(CC(=O)O)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C24H27NO5/c1-2-3-4-5-8-15-30-18-13-11-17(12-14-18)21(16-22(26)27)25-23(28)19-9-6-7-10-20(19)24(25)29/h6-7,9-14,21H,2-5,8,15-16H2,1H3,(H,26,27)