diethyl 5-azanyl-3-[(3-methyl-2-nitro-phenyl)carbonyloxymethyl]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-azanyl-3-[(3-methyl-2-nitro-phenyl)carbonyloxymethyl]thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-amino-3-[(3-methyl-2-nitro-benzoyl)oxymethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[(3-methyl-2-nitrophenyl)-oxomethoxy]methyl]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-amino-3-[(3-methyl-2-nitrobenzoyl)oxymethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[(3-methyl-2-nitro-benzoyl)oxymethyl]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C19H20N2O8S MolecularWeight: 436.4357

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1COC(=O)C2=C(C(=CC=C2)C)[N+](=O)[O-])C(=O)OCC)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1COC(=O)C2=C(C(=CC=C2)C)[N+](=O)[O-])C(=O)OCC)N

InChI

InChI=1S/C19H20N2O8S/c1-4-27-18(23)13-12(15(30-16(13)20)19(24)28-5-2)9-29-17(22)11-8-6-7-10(3)14(11)21(25)26/h6-8H,4-5,9,20H2,1-3H3