(phenylmethyl) (NE)-N-[azanyl-[(3S)-3-azanyl-2-oxidanylidene-piperidin-1-yl]methylidene]carbamate

Systemtic Name: (phenylmethyl) (NE)-N-[azanyl-[(3S)-3-azanyl-2-oxidanylidene-piperidin-1-yl]methylidene]carbamate Openeye Name: benzyl (NE)-N-[amino-[(3S)-3-amino-2-oxo-1-piperidyl]methylene]carbamate CAS Name: (NE)-N-[amino-[(3S)-3-amino-2-oxo-1-piperidinyl]methylidene]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl (NE)-N-[amino-[(3S)-3-amino-2-oxopiperidin-1-yl]methylidene]carbamate Traditional Name: (NE)-N-[amino-[(3S)-3-amino-2-keto-piperidino]methylene]carbamic acid benzyl ester Formula: C14H18N4O3 MolecularWeight: 290.31772

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)N(C1)C(=NC(=O)OCC2=CC=CC=C2)N)N

Isomeric SMILES

C1C[C@@H](C(=O)N(C1)/C(=N/C(=O)OCC2=CC=CC=C2)/N)N

InChI

InChI=1S/C14H18N4O3/c15-11-7-4-8-18(12(11)19)13(16)17-14(20)21-9-10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9,15H2,(H2,16,17,20)/t11-/m0/s1