phenyl 3-(2-chloranyl-6-nitro-phenyl)sulfanylpropanoate

Systemtic Name: phenyl 3-(2-chloranyl-6-nitro-phenyl)sulfanylpropanoate Openeye Name: phenyl 3-(2-chloro-6-nitro-phenyl)sulfanylpropanoate CAS Name: 3-[(2-chloro-6-nitrophenyl)thio]propanoic acid phenyl ester IUPAC Name: phenyl 3-(2-chloro-6-nitrophenyl)sulfanylpropanoate Traditional Name: 3-[(2-chloro-6-nitro-phenyl)thio]propionic acid phenyl ester Formula: C15H12ClNO4S MolecularWeight: 337.77808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)CCSC2=C(C=CC=C2Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OC(=O)CCSC2=C(C=CC=C2Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H12ClNO4S/c16-12-7-4-8-13(17(19)20)15(12)22-10-9-14(18)21-11-5-2-1-3-6-11/h1-8H,9-10H2