(4S)-3-[(2S)-2-[[(2S)-1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl]azaniumyl]propanoyl]-1-methyl-2-oxidanylidene-imidazolidine-4-carboxylate

Systemtic Name: (4S)-3-[(2S)-2-[[(2S)-1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl]azaniumyl]propanoyl]-1-methyl-2-oxidanylidene-imidazolidine-4-carboxylate Openeye Name: (4S)-3-[(2S)-2-[[(1S)-1-ethoxycarbonyl-3-phenyl-propyl]ammonio]propanoyl]-1-methyl-2-oxo-imidazolidine-4-carboxylate CAS Name: (4S)-3-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]ammonio]-1-oxopropyl]-1-methyl-2-oxo-4-imidazolidinecarboxylate IUPAC Name: (4S)-3-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]azaniumyl]propanoyl]-1-methyl-2-oxoimidazolidine-4-carboxylate Traditional Name: (4S)-3-[(2S)-2-[[(1S)-1-carbethoxy-3-phenyl-propyl]ammonio]propanoyl]-2-keto-1-methyl-imidazolidine-4-carboxylate Formula: C20H27N3O6 MolecularWeight: 405.44488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)[NH2+]C(C)C(=O)N2C(CN(C2=O)C)C(=O)[O-]

Isomeric SMILES

CCOC(=O)[C@H](CCC1=CC=CC=C1)[NH2+][C@@H](C)C(=O)N2[C@@H](CN(C2=O)C)C(=O)[O-]

InChI

InChI=1S/C20H27N3O6/c1-4-29-19(27)15(11-10-14-8-6-5-7-9-14)21-13(2)17(24)23-16(18(25)26)12-22(3)20(23)28/h5-9,13,15-16,21H,4,10-12H2,1-3H3,(H,25,26)/t13-,15-,16-/m0/s1