methyl 3-azanyl-5-(4-methoxy-3-nitro-phenyl)thiophene-2-carboxylate

Systemtic Name: methyl 3-azanyl-5-(4-methoxy-3-nitro-phenyl)thiophene-2-carboxylate Openeye Name: methyl 3-amino-5-(4-methoxy-3-nitro-phenyl)thiophene-2-carboxylate CAS Name: 3-amino-5-(4-methoxy-3-nitrophenyl)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-amino-5-(4-methoxy-3-nitrophenyl)thiophene-2-carboxylate Traditional Name: 3-amino-5-(4-methoxy-3-nitro-phenyl)thiophene-2-carboxylic acid methyl ester Formula: C13H12N2O5S MolecularWeight: 308.30978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=C(S2)C(=O)OC)N)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=C(S2)C(=O)OC)N)[N+](=O)[O-]

InChI

InChI=1S/C13H12N2O5S/c1-19-10-4-3-7(5-9(10)15(17)18)11-6-8(14)12(21-11)13(16)20-2/h3-6H,14H2,1-2H3