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

Systemtic Name: ethyl 2-(2-nitro-3-phenylsulfanyl-phenyl)ethanoate Openeye Name: ethyl 2-(2-nitro-3-phenylsulfanyl-phenyl)acetate CAS Name: 2-[2-nitro-3-(phenylthio)phenyl]acetic acid ethyl ester IUPAC Name: ethyl 2-(2-nitro-3-phenylsulfanylphenyl)acetate Traditional Name: 2-[2-nitro-3-(phenylthio)phenyl]acetic acid ethyl ester Formula: C16H15NO4S MolecularWeight: 317.3596

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(C(=CC=C1)SC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CC1=C(C(=CC=C1)SC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H15NO4S/c1-2-21-15(18)11-12-7-6-10-14(16(12)17(19)20)22-13-8-4-3-5-9-13/h3-10H,2,11H2,1H3