methyl 4-[2-(benzotriazol-1-yl)ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-(benzotriazol-1-yl)ethanoylamino]benzoate Openeye Name: methyl 4-[[2-(benzotriazol-1-yl)acetyl]amino]benzoate CAS Name: 4-[[2-(1-benzotriazolyl)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(benzotriazol-1-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(benzotriazol-1-yl)acetyl]amino]benzoic acid methyl ester Formula: C16H14N4O3 MolecularWeight: 310.30736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CN2C3=CC=CC=C3N=N2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C16H14N4O3/c1-23-16(22)11-6-8-12(9-7-11)17-15(21)10-20-14-5-3-2-4-13(14)18-19-20/h2-9H,10H2,1H3,(H,17,21)