(2R)-2-[4-[(4-butylphenyl)carbamoyl]phenoxy]-3-methyl-butanoic acid

Systemtic Name: (2R)-2-[4-[(4-butylphenyl)carbamoyl]phenoxy]-3-methyl-butanoic acid Openeye Name: (2R)-2-[4-[(4-butylphenyl)carbamoyl]phenoxy]-3-methyl-butanoic acid CAS Name: (2R)-2-[4-[(4-butylanilino)-oxomethyl]phenoxy]-3-methylbutanoic acid IUPAC Name: (2R)-2-[4-[(4-butylphenyl)carbamoyl]phenoxy]-3-methylbutanoic acid Traditional Name: (2R)-2-[4-[(4-butylphenyl)carbamoyl]phenoxy]-3-methyl-butyric acid Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)OC(C(C)C)C(=O)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)O[C@H](C(C)C)C(=O)O

InChI

InChI=1S/C22H27NO4/c1-4-5-6-16-7-11-18(12-8-16)23-21(24)17-9-13-19(14-10-17)27-20(15(2)3)22(25)26/h7-15,20H,4-6H2,1-3H3,(H,23,24)(H,25,26)/t20-/m1/s1