ethyl 2-[3-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[3-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[3-(4-nitro-1,3-dioxo-isoindolin-2-yl)propanoylamino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[3-(4-nitro-1,3-dioxo-2-isoindolyl)-1-oxopropyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(4-nitro-1,3-dioxoisoindol-2-yl)propanoylamino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[3-(1,3-diketo-4-nitro-isoindolin-2-yl)propanoylamino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C24H19N3O7S MolecularWeight: 493.48856

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CCN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CCN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H19N3O7S/c1-2-34-24(31)20-16(14-7-4-3-5-8-14)13-35-21(20)25-18(28)11-12-26-22(29)15-9-6-10-17(27(32)33)19(15)23(26)30/h3-10,13H,2,11-12H2,1H3,(H,25,28)