S-(4-nitrophenyl) 4-hexoxybenzenecarbothioate

Systemtic Name: S-(4-nitrophenyl) 4-hexoxybenzenecarbothioate Openeye Name: S-(4-nitrophenyl) 4-hexoxybenzenecarbothioate CAS Name: 4-hexoxybenzenecarbothioic acid S-(4-nitrophenyl) ester IUPAC Name: S-(4-nitrophenyl) 4-hexoxybenzenecarbothioate Traditional Name: 4-hexoxythiobenzoic acid S-(4-nitrophenyl) ester Formula: C19H21NO4S MolecularWeight: 359.43934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H21NO4S/c1-2-3-4-5-14-24-17-10-6-15(7-11-17)19(21)25-18-12-8-16(9-13-18)20(22)23/h6-13H,2-5,14H2,1H3