methyl 4-[2-[(5-aminocarbonyl-2-phenyl-1,2,3-triazol-4-yl)amino]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: methyl 4-[2-[(5-aminocarbonyl-2-phenyl-1,2,3-triazol-4-yl)amino]-2-oxidanylidene-ethoxy]benzoate Openeye Name: methyl 4-[2-[(5-carbamoyl-2-phenyl-triazol-4-yl)amino]-2-oxo-ethoxy]benzoate CAS Name: 4-[2-[(5-carbamoyl-2-phenyl-4-triazolyl)amino]-2-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[(5-carbamoyl-2-phenyltriazol-4-yl)amino]-2-oxoethoxy]benzoate Traditional Name: 4-[2-[(5-carbamoyl-2-phenyl-triazol-4-yl)amino]-2-keto-ethoxy]benzoic acid methyl ester Formula: C19H17N5O5 MolecularWeight: 395.36878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OCC(=O)NC2=NN(N=C2C(=O)N)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OCC(=O)NC2=NN(N=C2C(=O)N)C3=CC=CC=C3

InChI

InChI=1S/C19H17N5O5/c1-28-19(27)12-7-9-14(10-8-12)29-11-15(25)21-18-16(17(20)26)22-24(23-18)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H2,20,26)(H,21,23,25)