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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCCC(=O)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1OCCCC(=O)NC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C18H19NO4/c1-13-5-2-3-6-16(13)23-12-4-7-17(20)19-15-10-8-14(9-11-15)18(21)22/h2-3,5-6,8-11H,4,7,12H2,1H3,(H,19,20)(H,21,22)