3-[3-(3-methyl-4-propan-2-yl-phenoxy)propanoylamino]benzoic acid

Systemtic Name: 3-[3-(3-methyl-4-propan-2-yl-phenoxy)propanoylamino]benzoic acid Openeye Name: 3-[3-(4-isopropyl-3-methyl-phenoxy)propanoylamino]benzoic acid CAS Name: 3-[[3-(3-methyl-4-propan-2-ylphenoxy)-1-oxopropyl]amino]benzoic acid IUPAC Name: 3-[3-(3-methyl-4-propan-2-ylphenoxy)propanoylamino]benzoic acid Traditional Name: 3-[3-(4-isopropyl-3-methyl-phenoxy)propanoylamino]benzoic acid Formula: C20H23NO4 MolecularWeight: 341.40092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23NO4/c1-13(2)18-8-7-17(11-14(18)3)25-10-9-19(22)21-16-6-4-5-15(12-16)20(23)24/h4-8,11-13H,9-10H2,1-3H3,(H,21,22)(H,23,24)