2-[3-methyl-4-[[4-(3-methylbutanoylamino)phenyl]carbonylamino]phenoxy]ethanoic acid

Systemtic Name: 2-[3-methyl-4-[[4-(3-methylbutanoylamino)phenyl]carbonylamino]phenoxy]ethanoic acid Openeye Name: 2-[3-methyl-4-[[4-(3-methylbutanoylamino)benzoyl]amino]phenoxy]acetic acid CAS Name: 2-[3-methyl-4-[[[4-[(3-methyl-1-oxobutyl)amino]phenyl]-oxomethyl]amino]phenoxy]acetic acid IUPAC Name: 2-[3-methyl-4-[[4-(3-methylbutanoylamino)benzoyl]amino]phenoxy]acetic acid Traditional Name: 2-[4-[[4-(isovalerylamino)benzoyl]amino]-3-methyl-phenoxy]acetic acid Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)O)NC(=O)C2=CC=C(C=C2)NC(=O)CC(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)O)NC(=O)C2=CC=C(C=C2)NC(=O)CC(C)C

InChI

InChI=1S/C21H24N2O5/c1-13(2)10-19(24)22-16-6-4-15(5-7-16)21(27)23-18-9-8-17(11-14(18)3)28-12-20(25)26/h4-9,11,13H,10,12H2,1-3H3,(H,22,24)(H,23,27)(H,25,26)