(phenylmethyl) (3S)-3-[[(2-methylpropan-2-yl)oxycarbonylamino]carbamoyl]-1,2-diazinane-1-carboxylate

Systemtic Name: (phenylmethyl) (3S)-3-[[(2-methylpropan-2-yl)oxycarbonylamino]carbamoyl]-1,2-diazinane-1-carboxylate Openeye Name: benzyl (3S)-3-[(tert-butoxycarbonylamino)carbamoyl]hexahydropyridazine-1-carboxylate CAS Name: (3S)-3-[[[(2-methylpropan-2-yl)oxy-oxomethyl]hydrazo]-oxomethyl]-1-diazinanecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (3S)-3-[[(2-methylpropan-2-yl)oxycarbonylamino]carbamoyl]diazinane-1-carboxylate Traditional Name: (3S)-3-[(tert-butoxycarbonylamino)carbamoyl]hexahydropyridazine-1-carboxylic acid benzyl ester Formula: C18H26N4O5 MolecularWeight: 378.42284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NNC(=O)C1CCCN(N1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NNC(=O)[C@@H]1CCCN(N1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H26N4O5/c1-18(2,3)27-16(24)20-19-15(23)14-10-7-11-22(21-14)17(25)26-12-13-8-5-4-6-9-13/h4-6,8-9,14,21H,7,10-12H2,1-3H3,(H,19,23)(H,20,24)/t14-/m0/s1