4-[2-(3-methylphenoxy)butanoylamino]benzoic acid

Systemtic Name: 4-[2-(3-methylphenoxy)butanoylamino]benzoic acid Openeye Name: 4-[2-(3-methylphenoxy)butanoylamino]benzoic acid CAS Name: 4-[[2-(3-methylphenoxy)-1-oxobutyl]amino]benzoic acid IUPAC Name: 4-[2-(3-methylphenoxy)butanoylamino]benzoic acid Traditional Name: 4-[2-(3-methylphenoxy)butanoylamino]benzoic acid Formula: C18H19NO4 MolecularWeight: 313.34776

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)C(=O)O)OC2=CC=CC(=C2)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)C(=O)O)OC2=CC=CC(=C2)C

InChI

InChI=1S/C18H19NO4/c1-3-16(23-15-6-4-5-12(2)11-15)17(20)19-14-9-7-13(8-10-14)18(21)22/h4-11,16H,3H2,1-2H3,(H,19,20)(H,21,22)