ethyl 4-azanyl-5-nitro-2-phenylazanyl-thiophene-3-carboxylate

Systemtic Name: ethyl 4-azanyl-5-nitro-2-phenylazanyl-thiophene-3-carboxylate Openeye Name: ethyl 4-amino-2-anilino-5-nitro-thiophene-3-carboxylate CAS Name: 4-amino-2-anilino-5-nitro-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-anilino-5-nitrothiophene-3-carboxylate Traditional Name: 4-amino-2-anilino-5-nitro-thiophene-3-carboxylic acid ethyl ester Formula: C13H13N3O4S MolecularWeight: 307.32502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1N)[N+](=O)[O-])NC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1N)[N+](=O)[O-])NC2=CC=CC=C2

InChI

InChI=1S/C13H13N3O4S/c1-2-20-13(17)9-10(14)12(16(18)19)21-11(9)15-8-6-4-3-5-7-8/h3-7,15H,2,14H2,1H3