nitro 2-(3-methoxy-2-phenylsulfanyl-phenyl)ethanoate

Systemtic Name: nitro 2-(3-methoxy-2-phenylsulfanyl-phenyl)ethanoate Openeye Name: nitro 2-(3-methoxy-2-phenylsulfanyl-phenyl)acetate CAS Name: 2-[3-methoxy-2-(phenylthio)phenyl]acetic acid nitro ester IUPAC Name: nitro 2-(3-methoxy-2-phenylsulfanylphenyl)acetate Traditional Name: 2-[3-methoxy-2-(phenylthio)phenyl]acetic acid nitro ester Formula: C15H13NO5S MolecularWeight: 319.33242

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1SC2=CC=CC=C2)CC(=O)O[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1SC2=CC=CC=C2)CC(=O)O[N+](=O)[O-]

InChI

InChI=1S/C15H13NO5S/c1-20-13-9-5-6-11(10-14(17)21-16(18)19)15(13)22-12-7-3-2-4-8-12/h2-9H,10H2,1H3