benzotriazol-1-yl 5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-cyclohex-2-ene-1-carboxylate

Systemtic Name: benzotriazol-1-yl 5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-cyclohex-2-ene-1-carboxylate Openeye Name: benzotriazol-1-yl 5-(tert-butoxycarbonylamino)-4-oxo-cyclohex-2-ene-1-carboxylate CAS Name: 5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-oxo-1-cyclohex-2-enecarboxylic acid 1-benzotriazolyl ester IUPAC Name: benzotriazol-1-yl 5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxocyclohex-2-ene-1-carboxylate Traditional Name: 5-(tert-butoxycarbonylamino)-4-keto-cyclohex-2-ene-1-carboxylic acid benzotriazol-1-yl ester Formula: C18H20N4O5 MolecularWeight: 372.3752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CC(C=CC1=O)C(=O)ON2C3=CC=CC=C3N=N2

Isomeric SMILES

CC(C)(C)OC(=O)NC1CC(C=CC1=O)C(=O)ON2C3=CC=CC=C3N=N2

InChI

InChI=1S/C18H20N4O5/c1-18(2,3)26-17(25)19-13-10-11(8-9-15(13)23)16(24)27-22-14-7-5-4-6-12(14)20-21-22/h4-9,11,13H,10H2,1-3H3,(H,19,25)