1-[(2S)-2-azanyl-3-phenyl-propanoyl]-1-[(2S)-1-methoxy-1-oxidanyl-propan-2-yl]pyrrolidin-1-ium-2,5-dione

Systemtic Name: 1-[(2S)-2-azanyl-3-phenyl-propanoyl]-1-[(2S)-1-methoxy-1-oxidanyl-propan-2-yl]pyrrolidin-1-ium-2,5-dione Openeye Name: 1-[(2S)-2-amino-3-phenyl-propanoyl]-1-[(1S)-2-hydroxy-2-methoxy-1-methyl-ethyl]pyrrolidin-1-ium-2,5-dione CAS Name: 1-[(2S)-2-amino-1-oxo-3-phenylpropyl]-1-[(2S)-1-hydroxy-1-methoxypropan-2-yl]pyrrolidin-1-ium-2,5-dione IUPAC Name: 1-[(2S)-2-amino-3-phenylpropanoyl]-1-[(2S)-1-hydroxy-1-methoxypropan-2-yl]pyrrolidin-1-ium-2,5-dione Traditional Name: 1-[(2S)-2-amino-3-phenyl-propanoyl]-1-[(1S)-2-hydroxy-2-methoxy-1-methyl-ethyl]pyrrolidin-1-ium-2,5-quinone Formula: C17H23N2O5+ MolecularWeight: 335.37492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(O)OC)[N+]1(C(=O)CCC1=O)C(=O)C(CC2=CC=CC=C2)N

Isomeric SMILES

C[C@@H](C(O)OC)[N+]1(C(=O)CCC1=O)C(=O)[C@H](CC2=CC=CC=C2)N

InChI

InChI=1S/C17H23N2O5/c1-11(17(23)24-2)19(14(20)8-9-15(19)21)16(22)13(18)10-12-6-4-3-5-7-12/h3-7,11,13,17,23H,8-10,18H2,1-2H3/q+1/t11-,13-,17?/m0/s1