2-[4-[[1,3-bis(oxidanylidene)-2-propyl-isoindol-5-yl]carbonylamino]-3-methyl-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[[1,3-bis(oxidanylidene)-2-propyl-isoindol-5-yl]carbonylamino]-3-methyl-phenoxy]ethanoic acid Openeye Name: 2-[4-[(1,3-dioxo-2-propyl-isoindoline-5-carbonyl)amino]-3-methyl-phenoxy]acetic acid CAS Name: 2-[4-[[(1,3-dioxo-2-propyl-5-isoindolyl)-oxomethyl]amino]-3-methylphenoxy]acetic acid IUPAC Name: 2-[4-[(1,3-dioxo-2-propylisoindole-5-carbonyl)amino]-3-methylphenoxy]acetic acid Traditional Name: 2-[4-[(1,3-diketo-2-propyl-isoindoline-5-carbonyl)amino]-3-methyl-phenoxy]acetic acid Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=C(C=C(C=C3)OCC(=O)O)C

Isomeric SMILES

CCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=C(C=C(C=C3)OCC(=O)O)C

InChI

InChI=1S/C21H20N2O6/c1-3-8-23-20(27)15-6-4-13(10-16(15)21(23)28)19(26)22-17-7-5-14(9-12(17)2)29-11-18(24)25/h4-7,9-10H,3,8,11H2,1-2H3,(H,22,26)(H,24,25)