ethyl 3-azanyl-4-(methoxymethyl)-6-methyl-5-nitro-thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: ethyl 3-azanyl-4-(methoxymethyl)-6-methyl-5-nitro-thieno[2,3-b]pyridine-2-carboxylate Openeye Name: ethyl 3-amino-4-(methoxymethyl)-6-methyl-5-nitro-thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3-amino-4-(methoxymethyl)-6-methyl-5-nitro-2-thieno[2,3-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-amino-4-(methoxymethyl)-6-methyl-5-nitrothieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3-amino-4-(methoxymethyl)-6-methyl-5-nitro-thieno[2,3-b]pyridine-2-carboxylic acid ethyl ester Formula: C13H15N3O5S MolecularWeight: 325.3403

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C(=C(N=C2S1)C)[N+](=O)[O-])COC)N

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C(=C(N=C2S1)C)[N+](=O)[O-])COC)N

InChI

InChI=1S/C13H15N3O5S/c1-4-21-13(17)11-9(14)8-7(5-20-3)10(16(18)19)6(2)15-12(8)22-11/h4-5,14H2,1-3H3