5-(3-methoxyphenyl)sulfanyl-2-nitro-benzoate

Systemtic Name: 5-(3-methoxyphenyl)sulfanyl-2-nitro-benzoate Openeye Name: 5-(3-methoxyphenyl)sulfanyl-2-nitro-benzoate CAS Name: 5-[(3-methoxyphenyl)thio]-2-nitrobenzoate IUPAC Name: 5-(3-methoxyphenyl)sulfanyl-2-nitrobenzoate Traditional Name: 5-[(3-methoxyphenyl)thio]-2-nitro-benzoate Formula: C14H10NO5S- MolecularWeight: 304.2979

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)SC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

COC1=CC(=CC=C1)SC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C14H11NO5S/c1-20-9-3-2-4-10(7-9)21-11-5-6-13(15(18)19)12(8-11)14(16)17/h2-8H,1H3,(H,16,17)/p-1