methyl 3-chloranyl-4-[6-(3,5-diethyl-1,2-oxazol-4-yl)hexoxy]benzoate

Systemtic Name: methyl 3-chloranyl-4-[6-(3,5-diethyl-1,2-oxazol-4-yl)hexoxy]benzoate Openeye Name: methyl 3-chloro-4-[6-(3,5-diethylisoxazol-4-yl)hexoxy]benzoate CAS Name: 3-chloro-4-[6-(3,5-diethyl-4-isoxazolyl)hexoxy]benzoic acid methyl ester IUPAC Name: methyl 3-chloro-4-[6-(3,5-diethyl-1,2-oxazol-4-yl)hexoxy]benzoate Traditional Name: 3-chloro-4-[6-(3,5-diethylisoxazol-4-yl)hexoxy]benzoic acid methyl ester Formula: C21H28ClNO4 MolecularWeight: 393.90432

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NO1)CC)CCCCCCOC2=C(C=C(C=C2)C(=O)OC)Cl

Isomeric SMILES

CCC1=C(C(=NO1)CC)CCCCCCOC2=C(C=C(C=C2)C(=O)OC)Cl

InChI

InChI=1S/C21H28ClNO4/c1-4-18-16(19(5-2)27-23-18)10-8-6-7-9-13-26-20-12-11-15(14-17(20)22)21(24)25-3/h11-12,14H,4-10,13H2,1-3H3