[(2R,3S)-2-[(2R)-1-oxidanyl-1-oxidanylidene-pent-4-en-2-yl]-1-phenylmethoxycarbonyl-pyrrolidin-3-yl]azanium chloride

Systemtic Name: [(2R,3S)-2-[(2R)-1-oxidanyl-1-oxidanylidene-pent-4-en-2-yl]-1-phenylmethoxycarbonyl-pyrrolidin-3-yl]azanium chloride Openeye Name: [(2R,3S)-1-benzyloxycarbonyl-2-[(1R)-1-carboxybut-3-enyl]pyrrolidin-3-yl]ammonium chloride CAS Name: [(2R,3S)-2-[(2R)-1-hydroxy-1-oxopent-4-en-2-yl]-1-phenylmethoxycarbonyl-3-pyrrolidinyl]ammonium chloride IUPAC Name: [(2R,3S)-2-[(2R)-1-hydroxy-1-oxopent-4-en-2-yl]-1-phenylmethoxycarbonylpyrrolidin-3-yl]azanium chloride Traditional Name: [(2R,3S)-1-carbobenzoxy-2-[(1R)-1-carboxybut-3-enyl]pyrrolidin-3-yl]ammonium chloride Formula: C17H23ClN2O4 MolecularWeight: 354.82852

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(C1C(CCN1C(=O)OCC2=CC=CC=C2)[NH3+])C(=O)O.[Cl-]

Isomeric SMILES

C=CC[C@H]([C@@H]1[C@H](CCN1C(=O)OCC2=CC=CC=C2)[NH3+])C(=O)O.[Cl-]

InChI

InChI=1S/C17H22N2O4.ClH/c1-2-6-13(16(20)21)15-14(18)9-10-19(15)17(22)23-11-12-7-4-3-5-8-12;/h2-5,7-8,13-15H,1,6,9-11,18H2,(H,20,21);1H/t13-,14+,15-;/m1./s1