methyl 4-(3-chloranylpyrazin-2-yl)sulfanyl-2-methoxy-5-nitro-benzoate

Systemtic Name: methyl 4-(3-chloranylpyrazin-2-yl)sulfanyl-2-methoxy-5-nitro-benzoate Openeye Name: methyl 4-(3-chloropyrazin-2-yl)sulfanyl-2-methoxy-5-nitro-benzoate CAS Name: 4-[(3-chloro-2-pyrazinyl)thio]-2-methoxy-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-(3-chloropyrazin-2-yl)sulfanyl-2-methoxy-5-nitrobenzoate Traditional Name: 4-[(3-chloropyrazin-2-yl)thio]-2-methoxy-5-nitro-benzoic acid methyl ester Formula: C13H10ClN3O5S MolecularWeight: 355.7536

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OC)[N+](=O)[O-])SC2=NC=CN=C2Cl

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OC)[N+](=O)[O-])SC2=NC=CN=C2Cl

InChI

InChI=1S/C13H10ClN3O5S/c1-21-9-6-10(23-12-11(14)15-3-4-16-12)8(17(19)20)5-7(9)13(18)22-2/h3-6H,1-2H3