4-[3-(2,5-dimethylphenoxy)propanoylamino]-3-methyl-benzoic acid

Systemtic Name: 4-[3-(2,5-dimethylphenoxy)propanoylamino]-3-methyl-benzoic acid Openeye Name: 4-[3-(2,5-dimethylphenoxy)propanoylamino]-3-methyl-benzoic acid CAS Name: 4-[[3-(2,5-dimethylphenoxy)-1-oxopropyl]amino]-3-methylbenzoic acid IUPAC Name: 4-[3-(2,5-dimethylphenoxy)propanoylamino]-3-methylbenzoic acid Traditional Name: 4-[3-(2,5-dimethylphenoxy)propanoylamino]-3-methyl-benzoic acid Formula: C19H21NO4 MolecularWeight: 327.37434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCCC(=O)NC2=C(C=C(C=C2)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCCC(=O)NC2=C(C=C(C=C2)C(=O)O)C

InChI

InChI=1S/C19H21NO4/c1-12-4-5-13(2)17(10-12)24-9-8-18(21)20-16-7-6-15(19(22)23)11-14(16)3/h4-7,10-11H,8-9H2,1-3H3,(H,20,21)(H,22,23)