methyl 4-(5-azanyl-4-nitro-thiophen-2-yl)-3-methyl-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-(5-azanyl-4-nitro-thiophen-2-yl)-3-methyl-4-oxidanylidene-butanoate Openeye Name: methyl 4-(5-amino-4-nitro-2-thienyl)-3-methyl-4-oxo-butanoate CAS Name: 4-(5-amino-4-nitro-2-thiophenyl)-3-methyl-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-(5-amino-4-nitrothiophen-2-yl)-3-methyl-4-oxobutanoate Traditional Name: 4-(5-amino-4-nitro-2-thienyl)-4-keto-3-methyl-butyric acid methyl ester Formula: C10H12N2O5S MolecularWeight: 272.27768

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OC)C(=O)C1=CC(=C(S1)N)[N+](=O)[O-]

Isomeric SMILES

CC(CC(=O)OC)C(=O)C1=CC(=C(S1)N)[N+](=O)[O-]

InChI

InChI=1S/C10H12N2O5S/c1-5(3-8(13)17-2)9(14)7-4-6(12(15)16)10(11)18-7/h4-5H,3,11H2,1-2H3