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

Systemtic Name: (4S)-1-methyl-3-[(2S)-2-[[(2S)-1-oxidanidyl-1-oxidanylidene-4-phenyl-butan-2-yl]azaniumyl]propanoyl]-2-oxidanylidene-imidazolidine-4-carboxylate Openeye Name: (4S)-3-[(2S)-2-[[(1S)-1-carboxylato-3-phenyl-propyl]ammonio]propanoyl]-1-methyl-2-oxo-imidazolidine-4-carboxylate CAS Name: (4S)-1-methyl-3-[(2S)-2-[[(2S)-1-oxido-1-oxo-4-phenylbutan-2-yl]ammonio]-1-oxopropyl]-2-oxo-4-imidazolidinecarboxylate IUPAC Name: (4S)-1-methyl-3-[(2S)-2-[[(2S)-1-oxido-1-oxo-4-phenylbutan-2-yl]azaniumyl]propanoyl]-2-oxoimidazolidine-4-carboxylate Traditional Name: (4S)-3-[(2S)-2-[[(1S)-1-carboxylato-3-phenyl-propyl]ammonio]propanoyl]-2-keto-1-methyl-imidazolidine-4-carboxylate Formula: C18H22N3O6- MolecularWeight: 376.38378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1C(CN(C1=O)C)C(=O)[O-])[NH2+]C(CCC2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)N1[C@@H](CN(C1=O)C)C(=O)[O-])[NH2+][C@@H](CCC2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C18H23N3O6/c1-11(15(22)21-14(17(25)26)10-20(2)18(21)27)19-13(16(23)24)9-8-12-6-4-3-5-7-12/h3-7,11,13-14,19H,8-10H2,1-2H3,(H,23,24)(H,25,26)/p-1/t11-,13-,14-/m0/s1