ethyl 2-[[3-(4-chlorophenyl)-1,2-benzoxazol-6-yl]sulfanyl]propanoate

Systemtic Name: ethyl 2-[[3-(4-chlorophenyl)-1,2-benzoxazol-6-yl]sulfanyl]propanoate Openeye Name: ethyl 2-[[3-(4-chlorophenyl)-1,2-benzoxazol-6-yl]sulfanyl]propanoate CAS Name: 2-[[3-(4-chlorophenyl)-1,2-benzoxazol-6-yl]thio]propanoic acid ethyl ester IUPAC Name: ethyl 2-[[3-(4-chlorophenyl)-1,2-benzoxazol-6-yl]sulfanyl]propanoate Traditional Name: 2-[[3-(4-chlorophenyl)indoxazen-6-yl]thio]propionic acid ethyl ester Formula: C18H16ClNO3S MolecularWeight: 361.84254

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)SC1=CC2=C(C=C1)C(=NO2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C(C)SC1=CC2=C(C=C1)C(=NO2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H16ClNO3S/c1-3-22-18(21)11(2)24-14-8-9-15-16(10-14)23-20-17(15)12-4-6-13(19)7-5-12/h4-11H,3H2,1-2H3