diethyl 5-[(E)-(4-chloranyl-3-nitro-phenyl)methylideneamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[(E)-(4-chloranyl-3-nitro-phenyl)methylideneamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[(E)-(4-chloro-3-nitro-phenyl)methyleneamino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[(E)-(4-chloro-3-nitro-benzylidene)amino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C18H17ClN2O6S MolecularWeight: 424.85538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)N=CC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)/N=C/C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H17ClN2O6S/c1-4-26-17(22)14-10(3)15(18(23)27-5-2)28-16(14)20-9-11-6-7-12(19)13(8-11)21(24)25/h6-9H,4-5H2,1-3H3/b20-9+