(phenylmethyl) (2S)-2-azanyl-4-[[azanyl(dimethylamino)methylidene]amino]butanoate

Systemtic Name: (phenylmethyl) (2S)-2-azanyl-4-[[azanyl(dimethylamino)methylidene]amino]butanoate Openeye Name: benzyl (2S)-2-amino-4-[[amino(dimethylamino)methylene]amino]butanoate CAS Name: (2S)-2-amino-4-[[amino(dimethylamino)methylidene]amino]butanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-amino-4-[[amino(dimethylamino)methylidene]amino]butanoate Traditional Name: (2S)-2-amino-4-[[amino(dimethylamino)methylene]amino]butyric acid benzyl ester Formula: C14H22N4O2 MolecularWeight: 278.35008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=NCCC(C(=O)OCC1=CC=CC=C1)N)N

Isomeric SMILES

CN(C)C(=NCC[C@@H](C(=O)OCC1=CC=CC=C1)N)N

InChI

InChI=1S/C14H22N4O2/c1-18(2)14(16)17-9-8-12(15)13(19)20-10-11-6-4-3-5-7-11/h3-7,12H,8-10,15H2,1-2H3,(H2,16,17)/t12-/m0/s1