[2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] 1-ethylbenzotriazole-5-carboxylate

Systemtic Name: [2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] 1-ethylbenzotriazole-5-carboxylate Openeye Name: [2-[[(1R)-1-methylpropyl]carbamoylamino]-2-oxo-ethyl] 1-ethylbenzotriazole-5-carboxylate CAS Name: 1-ethyl-5-benzotriazolecarboxylic acid [2-[[[[(2R)-butan-2-yl]amino]-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxoethyl] 1-ethylbenzotriazole-5-carboxylate Traditional Name: 1-ethylbenzotriazole-5-carboxylic acid [2-keto-2-[[(1R)-1-methylpropyl]carbamoylamino]ethyl] ester Formula: C16H21N5O4 MolecularWeight: 347.36904

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC(=O)COC(=O)C1=CC2=C(C=C1)N(N=N2)CC

Isomeric SMILES

CC[C@@H](C)NC(=O)NC(=O)COC(=O)C1=CC2=C(C=C1)N(N=N2)CC

InChI

InChI=1S/C16H21N5O4/c1-4-10(3)17-16(24)18-14(22)9-25-15(23)11-6-7-13-12(8-11)19-20-21(13)5-2/h6-8,10H,4-5,9H2,1-3H3,(H2,17,18,22,24)/t10-/m1/s1