2-[1-[2-(4-methylphenyl)-1H-indol-3-yl]-3-oxidanylidene-1H-isoindol-2-yl]propanoic acid

Systemtic Name: 2-[1-[2-(4-methylphenyl)-1H-indol-3-yl]-3-oxidanylidene-1H-isoindol-2-yl]propanoic acid Openeye Name: 2-[1-oxo-3-[2-(p-tolyl)-1H-indol-3-yl]isoindolin-2-yl]propanoic acid CAS Name: 2-[1-[2-(4-methylphenyl)-1H-indol-3-yl]-3-oxo-1H-isoindol-2-yl]propanoic acid IUPAC Name: 2-[1-[2-(4-methylphenyl)-1H-indol-3-yl]-3-oxo-1H-isoindol-2-yl]propanoic acid Traditional Name: 2-[1-keto-3-[2-(p-tolyl)-1H-indol-3-yl]isoindolin-2-yl]propionic acid Formula: C26H22N2O3 MolecularWeight: 410.46448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)C4C5=CC=CC=C5C(=O)N4C(C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)C4C5=CC=CC=C5C(=O)N4C(C)C(=O)O

InChI

InChI=1S/C26H22N2O3/c1-15-11-13-17(14-12-15)23-22(20-9-5-6-10-21(20)27-23)24-18-7-3-4-8-19(18)25(29)28(24)16(2)26(30)31/h3-14,16,24,27H,1-2H3,(H,30,31)