(2S,4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-4-[(4-nitrophenyl)methoxycarbonyl]-1-phenylmethoxycarbonyl-pyrrolidine-2-carboxylic acid

Systemtic Name: (2S,4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-4-[(4-nitrophenyl)methoxycarbonyl]-1-phenylmethoxycarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: (2S,4S)-1-benzyloxycarbonyl-4-(9H-fluoren-9-ylmethoxycarbonylamino)-4-[(4-nitrophenyl)methoxycarbonyl]pyrrolidine-2-carboxylic acid CAS Name: (2S,4S)-4-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-[(4-nitrophenyl)methoxy-oxomethyl]-1-phenylmethoxycarbonyl-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-4-[(4-nitrophenyl)methoxycarbonyl]-1-phenylmethoxycarbonylpyrrolidine-2-carboxylic acid Traditional Name: (2S,4S)-1-carbobenzoxy-4-(9H-fluoren-9-ylmethoxycarbonylamino)-4-(4-nitrobenzyl)oxycarbonyl-proline Formula: C36H31N3O10 MolecularWeight: 665.64544

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC1(C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)C(=O)OCC6=CC=CC=C6)C(=O)O

Isomeric SMILES

C1[C@H](N(C[C@@]1(C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)C(=O)OCC6=CC=CC=C6)C(=O)O

InChI

InChI=1S/C36H31N3O10/c40-32(41)31-18-36(22-38(31)35(44)49-20-23-8-2-1-3-9-23,33(42)47-19-24-14-16-25(17-15-24)39(45)46)37-34(43)48-21-30-28-12-6-4-10-26(28)27-11-5-7-13-29(27)30/h1-17,30-31H,18-22H2,(H,37,43)(H,40,41)/t31-,36-/m0/s1