5-chloranyl-4-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoylamino]-2-methoxy-benzoic acid

Systemtic Name: 5-chloranyl-4-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoylamino]-2-methoxy-benzoic acid Openeye Name: 5-chloro-4-[3-(3,5-dimethylisoxazol-4-yl)propanoylamino]-2-methoxy-benzoic acid CAS Name: 5-chloro-4-[[3-(3,5-dimethyl-4-isoxazolyl)-1-oxopropyl]amino]-2-methoxybenzoic acid IUPAC Name: 5-chloro-4-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoylamino]-2-methoxybenzoic acid Traditional Name: 5-chloro-4-[3-(3,5-dimethylisoxazol-4-yl)propanoylamino]-2-methoxy-benzoic acid Formula: C16H17ClN2O5 MolecularWeight: 352.76958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CCC(=O)NC2=C(C=C(C(=C2)OC)C(=O)O)Cl

Isomeric SMILES

CC1=C(C(=NO1)C)CCC(=O)NC2=C(C=C(C(=C2)OC)C(=O)O)Cl

InChI

InChI=1S/C16H17ClN2O5/c1-8-10(9(2)24-19-8)4-5-15(20)18-13-7-14(23-3)11(16(21)22)6-12(13)17/h6-7H,4-5H2,1-3H3,(H,18,20)(H,21,22)