methyl 3-[(2R)-1-[(3-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl]oxybenzotriazole-5-carboxylate

Systemtic Name: methyl 3-[(2R)-1-[(3-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl]oxybenzotriazole-5-carboxylate Openeye Name: methyl 3-[(1R)-2-(3-cyanoanilino)-1-methyl-2-oxo-ethoxy]benzotriazole-5-carboxylate CAS Name: 3-[(2R)-1-(3-cyanoanilino)-1-oxopropan-2-yl]oxy-5-benzotriazolecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2R)-1-(3-cyanoanilino)-1-oxopropan-2-yl]oxybenzotriazole-5-carboxylate Traditional Name: 3-[(1R)-2-(3-cyanoanilino)-2-keto-1-methyl-ethoxy]benzotriazole-5-carboxylic acid methyl ester Formula: C18H15N5O4 MolecularWeight: 365.3428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C#N)ON2C3=C(C=CC(=C3)C(=O)OC)N=N2

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC(=C1)C#N)ON2C3=C(C=CC(=C3)C(=O)OC)N=N2

InChI

InChI=1S/C18H15N5O4/c1-11(17(24)20-14-5-3-4-12(8-14)10-19)27-23-16-9-13(18(25)26-2)6-7-15(16)21-22-23/h3-9,11H,1-2H3,(H,20,24)/t11-/m1/s1