methyl 6-[(5-nitrothiophen-2-yl)carbonylamino]hexanoate

Systemtic Name: methyl 6-[(5-nitrothiophen-2-yl)carbonylamino]hexanoate Openeye Name: methyl 6-[(5-nitrothiophene-2-carbonyl)amino]hexanoate CAS Name: 6-[[(5-nitro-2-thiophenyl)-oxomethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(5-nitrothiophene-2-carbonyl)amino]hexanoate Traditional Name: 6-[(5-nitrothiophene-2-carbonyl)amino]hexanoic acid methyl ester Formula: C12H16N2O5S MolecularWeight: 300.33084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O5S/c1-19-11(15)5-3-2-4-8-13-12(16)9-6-7-10(20-9)14(17)18/h6-7H,2-5,8H2,1H3,(H,13,16)