(phenylmethyl) 4-[[(2S)-1-diazanyl-1-oxidanylidene-propan-2-yl]carbamoyl]piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[[(2S)-1-diazanyl-1-oxidanylidene-propan-2-yl]carbamoyl]piperazine-1-carboxylate Openeye Name: benzyl 4-[[(1S)-2-hydrazino-1-methyl-2-oxo-ethyl]carbamoyl]piperazine-1-carboxylate CAS Name: 4-[[[(2S)-1-hydrazinyl-1-oxopropan-2-yl]amino]-oxomethyl]-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[[(2S)-1-hydrazinyl-1-oxopropan-2-yl]carbamoyl]piperazine-1-carboxylate Traditional Name: 4-[[(1S)-2-hydrazino-2-keto-1-methyl-ethyl]carbamoyl]piperazine-1-carboxylic acid benzyl ester Formula: C16H23N5O4 MolecularWeight: 349.38492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NN)NC(=O)N1CCN(CC1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)NN)NC(=O)N1CCN(CC1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C16H23N5O4/c1-12(14(22)19-17)18-15(23)20-7-9-21(10-8-20)16(24)25-11-13-5-3-2-4-6-13/h2-6,12H,7-11,17H2,1H3,(H,18,23)(H,19,22)/t12-/m0/s1