S-[2,9-bis(oxidanylidene)-9-phenyl-nonyl] benzenecarbothioate

Systemtic Name: S-[2,9-bis(oxidanylidene)-9-phenyl-nonyl] benzenecarbothioate Openeye Name: S-(2,9-dioxo-9-phenyl-nonyl) benzenecarbothioate CAS Name: benzenecarbothioic acid S-(2,9-dioxo-9-phenylnonyl) ester IUPAC Name: S-(2,9-dioxo-9-phenylnonyl) benzenecarbothioate Traditional Name: thiobenzoic acid S-(2,9-diketo-9-phenyl-nonyl) ester Formula: C22H24O3S MolecularWeight: 368.48916

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CCCCCCC(=O)CSC(=O)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CCCCCCC(=O)CSC(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H24O3S/c23-20(17-26-22(25)19-13-7-4-8-14-19)15-9-1-2-10-16-21(24)18-11-5-3-6-12-18/h3-8,11-14H,1-2,9-10,15-17H2