methyl 1-[4-(2-azanyl-3-methoxy-3-oxidanylidene-propyl)phenyl]-1,2,3-triazole-4-carboxylate

Systemtic Name: methyl 1-[4-(2-azanyl-3-methoxy-3-oxidanylidene-propyl)phenyl]-1,2,3-triazole-4-carboxylate Openeye Name: methyl 1-[4-(2-amino-3-methoxy-3-oxo-propyl)phenyl]triazole-4-carboxylate CAS Name: 1-[4-(2-amino-3-methoxy-3-oxopropyl)phenyl]-4-triazolecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-(2-amino-3-methoxy-3-oxopropyl)phenyl]triazole-4-carboxylate Traditional Name: 1-[4-(2-amino-3-keto-3-methoxy-propyl)phenyl]triazole-4-carboxylic acid methyl ester Formula: C14H16N4O4 MolecularWeight: 304.30124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(N=N1)C2=CC=C(C=C2)CC(C(=O)OC)N

Isomeric SMILES

COC(=O)C1=CN(N=N1)C2=CC=C(C=C2)CC(C(=O)OC)N

InChI

InChI=1S/C14H16N4O4/c1-21-13(19)11(15)7-9-3-5-10(6-4-9)18-8-12(16-17-18)14(20)22-2/h3-6,8,11H,7,15H2,1-2H3