methyl 4-(4-methoxyphenyl)sulfanyl-3-nitro-benzoate

Systemtic Name: methyl 4-(4-methoxyphenyl)sulfanyl-3-nitro-benzoate Openeye Name: methyl 4-(4-methoxyphenyl)sulfanyl-3-nitro-benzoate CAS Name: 4-[(4-methoxyphenyl)thio]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-(4-methoxyphenyl)sulfanyl-3-nitrobenzoate Traditional Name: 4-[(4-methoxyphenyl)thio]-3-nitro-benzoic acid methyl ester Formula: C15H13NO5S MolecularWeight: 319.33242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13NO5S/c1-20-11-4-6-12(7-5-11)22-14-8-3-10(15(17)21-2)9-13(14)16(18)19/h3-9H,1-2H3