ethyl 2,4-dimethyl-5-[(2S)-2-(5-nitrothiophen-2-yl)carbonyloxypropanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[(2S)-2-(5-nitrothiophen-2-yl)carbonyloxypropanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[(2S)-2-(5-nitrothiophene-2-carbonyl)oxypropanoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[(2S)-2-[(5-nitro-2-thiophenyl)-oxomethoxy]-1-oxopropyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[(2S)-2-(5-nitrothiophene-2-carbonyl)oxypropanoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[(2S)-2-(5-nitrothiophene-2-carbonyl)oxypropanoyl]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C17H18N2O7S MolecularWeight: 394.39902

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)C(C)OC(=O)C2=CC=C(S2)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)[C@H](C)OC(=O)C2=CC=C(S2)[N+](=O)[O-])C

InChI

InChI=1S/C17H18N2O7S/c1-5-25-17(22)13-8(2)14(18-9(13)3)15(20)10(4)26-16(21)11-6-7-12(27-11)19(23)24/h6-7,10,18H,5H2,1-4H3/t10-/m0/s1