(2R)-2-[[(2S)-1-ethoxy-1,4-bis(oxidanylidene)-4-phenyl-butan-2-yl]azaniumyl]propanoate

Systemtic Name: (2R)-2-[[(2S)-1-ethoxy-1,4-bis(oxidanylidene)-4-phenyl-butan-2-yl]azaniumyl]propanoate Openeye Name: (2R)-2-[[(1S)-1-ethoxycarbonyl-3-oxo-3-phenyl-propyl]ammonio]propanoate CAS Name: (2R)-2-[[(2S)-1-ethoxy-1,4-dioxo-4-phenylbutan-2-yl]ammonio]propanoate IUPAC Name: (2R)-2-[[(2S)-1-ethoxy-1,4-dioxo-4-phenylbutan-2-yl]azaniumyl]propanoate Traditional Name: (2R)-2-[[(1S)-1-carbethoxy-3-keto-3-phenyl-propyl]ammonio]propionate Formula: C15H19NO5 MolecularWeight: 293.31506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO5/c1-3-21-15(20)12(16-10(2)14(18)19)9-13(17)11-7-5-4-6-8-11/h4-8,10,12,16H,3,9H2,1-2H3,(H,18,19)/t10-,12+/m1/s1