S-quinolin-8-yl 4-chloranyl-3-nitro-benzenecarbothioate

Systemtic Name: S-quinolin-8-yl 4-chloranyl-3-nitro-benzenecarbothioate Openeye Name: S-(8-quinolyl) 4-chloro-3-nitro-benzenecarbothioate CAS Name: 4-chloro-3-nitrobenzenecarbothioic acid S-(8-quinolinyl) ester IUPAC Name: S-quinolin-8-yl 4-chloro-3-nitrobenzenecarbothioate Traditional Name: 4-chloro-3-nitro-thiobenzoic acid S-(8-quinolyl) ester Formula: C16H9ClN2O3S MolecularWeight: 344.77226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)SC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)SC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])N=CC=C2

InChI

InChI=1S/C16H9ClN2O3S/c17-12-7-6-11(9-13(12)19(21)22)16(20)23-14-5-1-3-10-4-2-8-18-15(10)14/h1-9H