S-quinolin-5-yl 4-nitrobenzenecarbothioate

Systemtic Name: S-quinolin-5-yl 4-nitrobenzenecarbothioate Openeye Name: S-(5-quinolyl) 4-nitrobenzenecarbothioate CAS Name: 4-nitrobenzenecarbothioic acid S-(5-quinolinyl) ester IUPAC Name: S-quinolin-5-yl 4-nitrobenzenecarbothioate Traditional Name: 4-nitrothiobenzoic acid S-(5-quinolyl) ester Formula: C16H10N2O3S MolecularWeight: 310.3272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC=N2)C(=C1)SC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=CC=N2)C(=C1)SC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H10N2O3S/c19-16(11-6-8-12(9-7-11)18(20)21)22-15-5-1-4-14-13(15)3-2-10-17-14/h1-10H