methyl 2-[[2-nitro-5-[(4-phenylphenyl)methoxy]phenyl]methylsulfanyl]ethanoate

Systemtic Name: methyl 2-[[2-nitro-5-[(4-phenylphenyl)methoxy]phenyl]methylsulfanyl]ethanoate Openeye Name: methyl 2-[[2-nitro-5-[(4-phenylphenyl)methoxy]phenyl]methylsulfanyl]acetate CAS Name: 2-[[2-nitro-5-[(4-phenylphenyl)methoxy]phenyl]methylthio]acetic acid methyl ester IUPAC Name: methyl 2-[[2-nitro-5-[(4-phenylphenyl)methoxy]phenyl]methylsulfanyl]acetate Traditional Name: 2-[[2-nitro-5-(4-phenylbenzyl)oxy-benzyl]thio]acetic acid methyl ester Formula: C23H21NO5S MolecularWeight: 423.48154

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSCC1=C(C=CC(=C1)OCC2=CC=C(C=C2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CSCC1=C(C=CC(=C1)OCC2=CC=C(C=C2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H21NO5S/c1-28-23(25)16-30-15-20-13-21(11-12-22(20)24(26)27)29-14-17-7-9-19(10-8-17)18-5-3-2-4-6-18/h2-13H,14-16H2,1H3