O-propyl 5-[2,4-bis(chloranyl)phenoxy]-2-nitro-benzenecarbothioate

Systemtic Name: O-propyl 5-[2,4-bis(chloranyl)phenoxy]-2-nitro-benzenecarbothioate Openeye Name: O-propyl 5-(2,4-dichlorophenoxy)-2-nitro-benzenecarbothioate CAS Name: 5-(2,4-dichlorophenoxy)-2-nitrobenzenecarbothioic acid O-propyl ester IUPAC Name: O-propyl 5-(2,4-dichlorophenoxy)-2-nitrobenzenecarbothioate Traditional Name: 5-(2,4-dichlorophenoxy)-2-nitro-thiobenzoic acid O-propyl ester Formula: C16H13Cl2NO4S MolecularWeight: 386.24972

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=S)C1=C(C=CC(=C1)OC2=C(C=C(C=C2)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCOC(=S)C1=C(C=CC(=C1)OC2=C(C=C(C=C2)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H13Cl2NO4S/c1-2-7-22-16(24)12-9-11(4-5-14(12)19(20)21)23-15-6-3-10(17)8-13(15)18/h3-6,8-9H,2,7H2,1H3