2-[[7-chloranyl-3-(5-methylthiophen-2-yl)-1,2-benzoxazol-6-yl]oxy]butanoate

Systemtic Name: 2-[[7-chloranyl-3-(5-methylthiophen-2-yl)-1,2-benzoxazol-6-yl]oxy]butanoate Openeye Name: 2-[[7-chloro-3-(5-methyl-2-thienyl)-1,2-benzoxazol-6-yl]oxy]butanoate CAS Name: 2-[[7-chloro-3-(5-methyl-2-thiophenyl)-1,2-benzoxazol-6-yl]oxy]butanoate IUPAC Name: 2-[[7-chloro-3-(5-methylthiophen-2-yl)-1,2-benzoxazol-6-yl]oxy]butanoate Traditional Name: 2-[7-chloro-3-(5-methyl-2-thienyl)indoxazen-6-yl]oxybutyrate Formula: C16H13ClNO4S- MolecularWeight: 350.79672

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])OC1=C(C2=C(C=C1)C(=NO2)C3=CC=C(S3)C)Cl

Isomeric SMILES

CCC(C(=O)[O-])OC1=C(C2=C(C=C1)C(=NO2)C3=CC=C(S3)C)Cl

InChI

InChI=1S/C16H14ClNO4S/c1-3-10(16(19)20)21-11-6-5-9-14(12-7-4-8(2)23-12)18-22-15(9)13(11)17/h4-7,10H,3H2,1-2H3,(H,19,20)/p-1