ethyl 4-(5-methylfuran-2-yl)-2-[2-(3-nitro-4-pyrrolidin-1-yl-phenyl)carbonyloxyethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(5-methylfuran-2-yl)-2-[2-(3-nitro-4-pyrrolidin-1-yl-phenyl)carbonyloxyethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(5-methyl-2-furyl)-2-[[2-(3-nitro-4-pyrrolidin-1-yl-benzoyl)oxyacetyl]amino]thiophene-3-carboxylate CAS Name: 4-(5-methyl-2-furanyl)-2-[[2-[[3-nitro-4-(1-pyrrolidinyl)phenyl]-oxomethoxy]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(5-methylfuran-2-yl)-2-[[2-(3-nitro-4-pyrrolidin-1-ylbenzoyl)oxyacetyl]amino]thiophene-3-carboxylate Traditional Name: 4-(5-methyl-2-furyl)-2-[[2-(3-nitro-4-pyrrolidino-benzoyl)oxyacetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C25H25N3O8S MolecularWeight: 527.5463

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(O2)C)NC(=O)COC(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(O2)C)NC(=O)COC(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C25H25N3O8S/c1-3-34-25(31)22-17(20-9-6-15(2)36-20)14-37-23(22)26-21(29)13-35-24(30)16-7-8-18(19(12-16)28(32)33)27-10-4-5-11-27/h6-9,12,14H,3-5,10-11,13H2,1-2H3,(H,26,29)