ethyl 2-[(E)-(2-bromanyl-4-nitro-phenyl)methylideneamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(E)-(2-bromanyl-4-nitro-phenyl)methylideneamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(E)-(2-bromo-4-nitro-phenyl)methyleneamino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[(E)-(2-bromo-4-nitrophenyl)methylideneamino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(E)-(2-bromo-4-nitrophenyl)methylideneamino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[(E)-(2-bromo-4-nitro-benzylidene)amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C16H15BrN2O4S MolecularWeight: 411.2703

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15BrN2O4S/c1-4-23-16(20)14-9(2)10(3)24-15(14)18-8-11-5-6-12(19(21)22)7-13(11)17/h5-8H,4H2,1-3H3/b18-8+