ethyl 5-ethanoyl-4-methyl-2-[6-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]hexanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethanoyl-4-methyl-2-[6-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]hexanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-4-methyl-2-[6-(4-nitro-1,3-dioxo-isoindolin-2-yl)hexanoylamino]thiophene-3-carboxylate CAS Name: 5-acetyl-4-methyl-2-[[6-(4-nitro-1,3-dioxo-2-isoindolyl)-1-oxohexyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-4-methyl-2-[6-(4-nitro-1,3-dioxoisoindol-2-yl)hexanoylamino]thiophene-3-carboxylate Traditional Name: 5-acetyl-2-[6-(1,3-diketo-4-nitro-isoindolin-2-yl)hexanoylamino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C24H25N3O8S MolecularWeight: 515.5356

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)CCCCCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)CCCCCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H25N3O8S/c1-4-35-24(32)18-13(2)20(14(3)28)36-21(18)25-17(29)11-6-5-7-12-26-22(30)15-9-8-10-16(27(33)34)19(15)23(26)31/h8-10H,4-7,11-12H2,1-3H3,(H,25,29)