4-chloranyl-3-[2-(4-propanoylphenoxy)ethanoylamino]benzoic acid

Systemtic Name: 4-chloranyl-3-[2-(4-propanoylphenoxy)ethanoylamino]benzoic acid Openeye Name: 4-chloro-3-[[2-(4-propanoylphenoxy)acetyl]amino]benzoic acid CAS Name: 4-chloro-3-[[1-oxo-2-[4-(1-oxopropyl)phenoxy]ethyl]amino]benzoic acid IUPAC Name: 4-chloro-3-[[2-(4-propanoylphenoxy)acetyl]amino]benzoic acid Traditional Name: 4-chloro-3-[[2-(4-propionylphenoxy)acetyl]amino]benzoic acid Formula: C18H16ClNO5 MolecularWeight: 361.77634

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC(=O)NC2=C(C=CC(=C2)C(=O)O)Cl

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCC(=O)NC2=C(C=CC(=C2)C(=O)O)Cl

InChI

InChI=1S/C18H16ClNO5/c1-2-16(21)11-3-6-13(7-4-11)25-10-17(22)20-15-9-12(18(23)24)5-8-14(15)19/h3-9H,2,10H2,1H3,(H,20,22)(H,23,24)