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

Systemtic Name: 4-[3-(4-tert-butylphenoxy)propanoylamino]-3-methyl-benzoic acid Openeye Name: 4-[3-(4-tert-butylphenoxy)propanoylamino]-3-methyl-benzoic acid CAS Name: 4-[[3-(4-tert-butylphenoxy)-1-oxopropyl]amino]-3-methylbenzoic acid IUPAC Name: 4-[3-(4-tert-butylphenoxy)propanoylamino]-3-methylbenzoic acid Traditional Name: 4-[3-(4-tert-butylphenoxy)propanoylamino]-3-methyl-benzoic acid Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)CCOC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)CCOC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C21H25NO4/c1-14-13-15(20(24)25)5-10-18(14)22-19(23)11-12-26-17-8-6-16(7-9-17)21(2,3)4/h5-10,13H,11-12H2,1-4H3,(H,22,23)(H,24,25)