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

Systemtic Name: (4S)-3-[(2S)-2-[[(2S)-1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl]azaniumyl]propanoyl]-2-oxidanylidene-imidazolidine-4-carboxylate Openeye Name: (4S)-3-[(2S)-2-[[(1S)-1-ethoxycarbonyl-3-phenyl-propyl]ammonio]propanoyl]-2-oxo-imidazolidine-4-carboxylate CAS Name: (4S)-3-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]ammonio]-1-oxopropyl]-2-oxo-4-imidazolidinecarboxylate IUPAC Name: (4S)-3-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]azaniumyl]propanoyl]-2-oxoimidazolidine-4-carboxylate Traditional Name: (4S)-3-[(2S)-2-[[(1S)-1-carbethoxy-3-phenyl-propyl]ammonio]propanoyl]-2-keto-imidazolidine-4-carboxylate Formula: C19H25N3O6 MolecularWeight: 391.4183

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)[NH2+]C(C)C(=O)N2C(CNC2=O)C(=O)[O-]

Isomeric SMILES

CCOC(=O)[C@H](CCC1=CC=CC=C1)[NH2+][C@@H](C)C(=O)N2[C@@H](CNC2=O)C(=O)[O-]

InChI

InChI=1S/C19H25N3O6/c1-3-28-18(26)14(10-9-13-7-5-4-6-8-13)21-12(2)16(23)22-15(17(24)25)11-20-19(22)27/h4-8,12,14-15,21H,3,9-11H2,1-2H3,(H,20,27)(H,24,25)/t12-,14-,15-/m0/s1