(4-nitrophenyl) 4-methyl-2-[1-oxidanyl-2-(triphenylmethyl)sulfanyl-ethyl]pentanoate

Systemtic Name: (4-nitrophenyl) 4-methyl-2-[1-oxidanyl-2-(triphenylmethyl)sulfanyl-ethyl]pentanoate Openeye Name: (4-nitrophenyl) 2-(1-hydroxy-2-tritylsulfanyl-ethyl)-4-methyl-pentanoate CAS Name: 2-[1-hydroxy-2-[(triphenylmethyl)thio]ethyl]-4-methylpentanoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 2-(1-hydroxy-2-tritylsulfanylethyl)-4-methylpentanoate Traditional Name: 2-[1-hydroxy-2-(tritylthio)ethyl]-4-methyl-valeric acid (4-nitrophenyl) ester Formula: C33H33NO5S MolecularWeight: 555.68382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)O)C(=O)OC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C)CC(C(CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)O)C(=O)OC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C33H33NO5S/c1-24(2)22-30(32(36)39-29-20-18-28(19-21-29)34(37)38)31(35)23-40-33(25-12-6-3-7-13-25,26-14-8-4-9-15-26)27-16-10-5-11-17-27/h3-21,24,30-31,35H,22-23H2,1-2H3