(2S)-3,3-dimethyl-2-[3-[(2-nitrophenyl)methyl]-2-oxidanylidene-imidazolidin-1-yl]butanoic acid

Systemtic Name: (2S)-3,3-dimethyl-2-[3-[(2-nitrophenyl)methyl]-2-oxidanylidene-imidazolidin-1-yl]butanoic acid Openeye Name: (2S)-3,3-dimethyl-2-[3-[(2-nitrophenyl)methyl]-2-oxo-imidazolidin-1-yl]butanoic acid CAS Name: (2S)-3,3-dimethyl-2-[3-[(2-nitrophenyl)methyl]-2-oxo-1-imidazolidinyl]butanoic acid IUPAC Name: (2S)-3,3-dimethyl-2-[3-[(2-nitrophenyl)methyl]-2-oxoimidazolidin-1-yl]butanoic acid Traditional Name: (2S)-2-[2-keto-3-(2-nitrobenzyl)imidazolidin-1-yl]-3,3-dimethyl-butyric acid Formula: C16H21N3O5 MolecularWeight: 335.35504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)O)N1CCN(C1=O)CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)[C@@H](C(=O)O)N1CCN(C1=O)CC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H21N3O5/c1-16(2,3)13(14(20)21)18-9-8-17(15(18)22)10-11-6-4-5-7-12(11)19(23)24/h4-7,13H,8-10H2,1-3H3,(H,20,21)/t13-/m1/s1