3-bromanyl-5-chloranyl-4-[5-(3-methyl-1,2-oxazol-5-yl)pentoxy]benzoic acid

Systemtic Name: 3-bromanyl-5-chloranyl-4-[5-(3-methyl-1,2-oxazol-5-yl)pentoxy]benzoic acid Openeye Name: 3-bromo-5-chloro-4-[5-(3-methylisoxazol-5-yl)pentoxy]benzoic acid CAS Name: 3-bromo-5-chloro-4-[5-(3-methyl-5-isoxazolyl)pentoxy]benzoic acid IUPAC Name: 3-bromo-5-chloro-4-[5-(3-methyl-1,2-oxazol-5-yl)pentoxy]benzoic acid Traditional Name: 3-bromo-5-chloro-4-[5-(3-methylisoxazol-5-yl)pentoxy]benzoic acid Formula: C16H17BrClNO4 MolecularWeight: 402.66748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CCCCCOC2=C(C=C(C=C2Br)C(=O)O)Cl

Isomeric SMILES

CC1=NOC(=C1)CCCCCOC2=C(C=C(C=C2Br)C(=O)O)Cl

InChI

InChI=1S/C16H17BrClNO4/c1-10-7-12(23-19-10)5-3-2-4-6-22-15-13(17)8-11(16(20)21)9-14(15)18/h7-9H,2-6H2,1H3,(H,20,21)