S-(4-nitrophenyl) octadecanethioate

Systemtic Name: S-(4-nitrophenyl) octadecanethioate Openeye Name: S-(4-nitrophenyl) octadecanethioate CAS Name: octadecanethioic acid S-(4-nitrophenyl) ester IUPAC Name: S-(4-nitrophenyl) octadecanethioate Traditional Name: octadecanethioic acid S-(4-nitrophenyl) ester Formula: C24H39NO3S MolecularWeight: 421.63636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)SC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)SC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C24H39NO3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24(26)29-23-20-18-22(19-21-23)25(27)28/h18-21H,2-17H2,1H3