4-(4-methoxy-2-nitro-phenyl)sulfanylbenzoate

Systemtic Name: 4-(4-methoxy-2-nitro-phenyl)sulfanylbenzoate Openeye Name: 4-(4-methoxy-2-nitro-phenyl)sulfanylbenzoate CAS Name: 4-[(4-methoxy-2-nitrophenyl)thio]benzoate IUPAC Name: 4-(4-methoxy-2-nitrophenyl)sulfanylbenzoate Traditional Name: 4-[(4-methoxy-2-nitro-phenyl)thio]benzoate Formula: C14H10NO5S- MolecularWeight: 304.2979

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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