2-methylpropyl 2-azanyl-5-nitro-thiophene-3-carboxylate

Systemtic Name: 2-methylpropyl 2-azanyl-5-nitro-thiophene-3-carboxylate Openeye Name: isobutyl 2-amino-5-nitro-thiophene-3-carboxylate CAS Name: 2-amino-5-nitro-3-thiophenecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-amino-5-nitrothiophene-3-carboxylate Traditional Name: 2-amino-5-nitro-thiophene-3-carboxylic acid isobutyl ester Formula: C9H12N2O4S MolecularWeight: 244.26758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=C(SC(=C1)[N+](=O)[O-])N

Isomeric SMILES

CC(C)COC(=O)C1=C(SC(=C1)[N+](=O)[O-])N

InChI

InChI=1S/C9H12N2O4S/c1-5(2)4-15-9(12)6-3-7(11(13)14)16-8(6)10/h3,5H,4,10H2,1-2H3