[4-(4-nitrophenyl)sulfanylcarbonylphenyl] nonanoate

Systemtic Name: [4-(4-nitrophenyl)sulfanylcarbonylphenyl] nonanoate Openeye Name: [4-(4-nitrophenyl)sulfanylcarbonylphenyl] nonanoate CAS Name: nonanoic acid [4-[[(4-nitrophenyl)thio]-oxomethyl]phenyl] ester IUPAC Name: [4-(4-nitrophenyl)sulfanylcarbonylphenyl] nonanoate Traditional Name: pelargonic acid [4-[(4-nitrophenyl)thio]carbonylphenyl] ester Formula: C22H25NO5S MolecularWeight: 415.5026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)OC1=CC=C(C=C1)C(=O)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCC(=O)OC1=CC=C(C=C1)C(=O)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C22H25NO5S/c1-2-3-4-5-6-7-8-21(24)28-19-13-9-17(10-14-19)22(25)29-20-15-11-18(12-16-20)23(26)27/h9-16H,2-8H2,1H3