4-[4-(4-tert-butylphenoxy)butanoylamino]-3-methyl-benzoic acid

Systemtic Name: 4-[4-(4-tert-butylphenoxy)butanoylamino]-3-methyl-benzoic acid Openeye Name: 4-[4-(4-tert-butylphenoxy)butanoylamino]-3-methyl-benzoic acid CAS Name: 4-[[4-(4-tert-butylphenoxy)-1-oxobutyl]amino]-3-methylbenzoic acid IUPAC Name: 4-[4-(4-tert-butylphenoxy)butanoylamino]-3-methylbenzoic acid Traditional Name: 4-[4-(4-tert-butylphenoxy)butanoylamino]-3-methyl-benzoic acid Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)CCCOC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)CCCOC2=CC=C(C=C2)C(C)(C)C

InChI

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