2-[4-cyano-2-[(4-methyl-2-naphthalen-1-yl-pentanoyl)amino]phenoxy]ethanoic acid

Systemtic Name: 2-[4-cyano-2-[(4-methyl-2-naphthalen-1-yl-pentanoyl)amino]phenoxy]ethanoic acid Openeye Name: 2-[4-cyano-2-[[4-methyl-2-(1-naphthyl)pentanoyl]amino]phenoxy]acetic acid CAS Name: 2-[4-cyano-2-[[4-methyl-2-(1-naphthalenyl)-1-oxopentyl]amino]phenoxy]acetic acid IUPAC Name: 2-[4-cyano-2-[(4-methyl-2-naphthalen-1-ylpentanoyl)amino]phenoxy]acetic acid Traditional Name: 2-[4-cyano-2-[[4-methyl-2-(1-naphthyl)pentanoyl]amino]phenoxy]acetic acid Formula: C25H24N2O4 MolecularWeight: 416.46906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=C(C=CC(=C3)C#N)OCC(=O)O

Isomeric SMILES

CC(C)CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=C(C=CC(=C3)C#N)OCC(=O)O

InChI

InChI=1S/C25H24N2O4/c1-16(2)12-21(20-9-5-7-18-6-3-4-8-19(18)20)25(30)27-22-13-17(14-26)10-11-23(22)31-15-24(28)29/h3-11,13,16,21H,12,15H2,1-2H3,(H,27,30)(H,28,29)