4-chloranyl-2-[3-(3-methylphenoxy)propanoylamino]benzoic acid

Systemtic Name: 4-chloranyl-2-[3-(3-methylphenoxy)propanoylamino]benzoic acid Openeye Name: 4-chloro-2-[3-(3-methylphenoxy)propanoylamino]benzoic acid CAS Name: 4-chloro-2-[[3-(3-methylphenoxy)-1-oxopropyl]amino]benzoic acid IUPAC Name: 4-chloro-2-[3-(3-methylphenoxy)propanoylamino]benzoic acid Traditional Name: 4-chloro-2-[3-(3-methylphenoxy)propanoylamino]benzoic acid Formula: C17H16ClNO4 MolecularWeight: 333.76624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16ClNO4/c1-11-3-2-4-13(9-11)23-8-7-16(20)19-15-10-12(18)5-6-14(15)17(21)22/h2-6,9-10H,7-8H2,1H3,(H,19,20)(H,21,22)