ethyl 5-azanyl-1-[4-(furan-2-ylcarbonylamino)phenyl]-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-1-[4-(furan-2-ylcarbonylamino)phenyl]-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 5-amino-1-[4-(furan-2-carbonylamino)phenyl]triazole-4-carboxylate CAS Name: 5-amino-1-[4-[[2-furanyl(oxo)methyl]amino]phenyl]-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-[4-(furan-2-carbonylamino)phenyl]triazole-4-carboxylate Traditional Name: 5-amino-1-[4-(2-furoylamino)phenyl]triazole-4-carboxylic acid ethyl ester Formula: C16H15N5O4 MolecularWeight: 341.3214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=N1)C2=CC=C(C=C2)NC(=O)C3=CC=CO3)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=N1)C2=CC=C(C=C2)NC(=O)C3=CC=CO3)N

InChI

InChI=1S/C16H15N5O4/c1-2-24-16(23)13-14(17)21(20-19-13)11-7-5-10(6-8-11)18-15(22)12-4-3-9-25-12/h3-9H,2,17H2,1H3,(H,18,22)