ethyl 5-azanyl-4-cyano-3-[(2-nitrophenoxy)methyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[(2-nitrophenoxy)methyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[(2-nitrophenoxy)methyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[(2-nitrophenoxy)methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[(2-nitrophenoxy)methyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[(2-nitrophenoxy)methyl]thiophene-2-carboxylic acid ethyl ester Formula: C15H13N3O5S MolecularWeight: 347.34582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C15H13N3O5S/c1-2-22-15(19)13-10(9(7-16)14(17)24-13)8-23-12-6-4-3-5-11(12)18(20)21/h3-6H,2,8,17H2,1H3