dimethyl 2-[(3,5-dinitrophenyl)carbonylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate

Systemtic Name: dimethyl 2-[(3,5-dinitrophenyl)carbonylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate Openeye Name: dimethyl 2-[(3,5-dinitrobenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate CAS Name: 2-[[(3,5-dinitrophenyl)-oxomethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[(3,5-dinitrobenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate Traditional Name: 2-[(3,5-dinitrobenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylic acid dimethyl ester Formula: C18H15N3O9S MolecularWeight: 449.3914

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC2=C1C(=C(S2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COC(=O)C1CCC2=C1C(=C(S2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C18H15N3O9S/c1-29-17(23)11-3-4-12-13(11)14(18(24)30-2)16(31-12)19-15(22)8-5-9(20(25)26)7-10(6-8)21(27)28/h5-7,11H,3-4H2,1-2H3,(H,19,22)