O2-methyl O4-propan-2-yl 3-methyl-5-[(3-nitrophenyl)carbonylamino]thiophene-2,4-dicarboxylate

Systemtic Name: O2-methyl O4-propan-2-yl 3-methyl-5-[(3-nitrophenyl)carbonylamino]thiophene-2,4-dicarboxylate Openeye Name: O4-isopropyl O2-methyl 3-methyl-5-[(3-nitrobenzoyl)amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[(3-nitrophenyl)-oxomethyl]amino]thiophene-2,4-dicarboxylic acid O2-methyl ester O4-propan-2-yl ester IUPAC Name: 2-O-methyl 4-O-propan-2-yl 3-methyl-5-[(3-nitrobenzoyl)amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[(3-nitrobenzoyl)amino]thiophene-2,4-dicarboxylic acid O4-isopropyl ester O2-methyl ester Formula: C18H18N2O7S MolecularWeight: 406.40972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C18H18N2O7S/c1-9(2)27-17(22)13-10(3)14(18(23)26-4)28-16(13)19-15(21)11-6-5-7-12(8-11)20(24)25/h5-9H,1-4H3,(H,19,21)