2-[(3-methanoyl-4-methyl-3-oxidanidyl-imidazolidin-3-ium-1-yl)carbonylamino]-2-phenyl-ethanoic acid

Systemtic Name: 2-[(3-methanoyl-4-methyl-3-oxidanidyl-imidazolidin-3-ium-1-yl)carbonylamino]-2-phenyl-ethanoic acid Openeye Name: 2-[(3-formyl-4-methyl-3-oxido-imidazolidin-3-ium-1-carbonyl)amino]-2-phenyl-acetic acid CAS Name: 2-[[(3-formyl-4-methyl-3-oxido-1-imidazolidin-3-iumyl)-oxomethyl]amino]-2-phenylacetic acid IUPAC Name: 2-[(3-formyl-4-methyl-3-oxidoimidazolidin-3-ium-1-carbonyl)amino]-2-phenylacetic acid Traditional Name: 2-[(3-formyl-4-methyl-3-oxido-imidazolidin-3-ium-1-carbonyl)amino]-2-phenyl-acetic acid Formula: C14H17N3O5 MolecularWeight: 307.30188

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C[N+]1(C=O)[O-])C(=O)NC(C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC1CN(C[N+]1(C=O)[O-])C(=O)NC(C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C14H17N3O5/c1-10-7-16(8-17(10,22)9-18)14(21)15-12(13(19)20)11-5-3-2-4-6-11/h2-6,9-10,12H,7-8H2,1H3,(H,15,21)(H,19,20)