methyl 3-[2-[[(2S)-3-methylbutan-2-yl]amino]-2-oxidanylidene-ethoxy]benzotriazole-5-carboxylate

Systemtic Name: methyl 3-[2-[[(2S)-3-methylbutan-2-yl]amino]-2-oxidanylidene-ethoxy]benzotriazole-5-carboxylate Openeye Name: methyl 3-[2-[[(1S)-1,2-dimethylpropyl]amino]-2-oxo-ethoxy]benzotriazole-5-carboxylate CAS Name: 3-[2-[[(2S)-3-methylbutan-2-yl]amino]-2-oxoethoxy]-5-benzotriazolecarboxylic acid methyl ester IUPAC Name: methyl 3-[2-[[(2S)-3-methylbutan-2-yl]amino]-2-oxoethoxy]benzotriazole-5-carboxylate Traditional Name: 3-[2-[[(1S)-1,2-dimethylpropyl]amino]-2-keto-ethoxy]benzotriazole-5-carboxylic acid methyl ester Formula: C15H20N4O4 MolecularWeight: 320.3437

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)NC(=O)CON1C2=C(C=CC(=C2)C(=O)OC)N=N1

Isomeric SMILES

C[C@@H](C(C)C)NC(=O)CON1C2=C(C=CC(=C2)C(=O)OC)N=N1

InChI

InChI=1S/C15H20N4O4/c1-9(2)10(3)16-14(20)8-23-19-13-7-11(15(21)22-4)5-6-12(13)17-18-19/h5-7,9-10H,8H2,1-4H3,(H,16,20)/t10-/m0/s1