(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-[(4-nitrophenyl)methoxycarbonylamino]pentanoic acid

Systemtic Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-[(4-nitrophenyl)methoxycarbonylamino]pentanoic acid Openeye Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-[(4-nitrophenyl)methoxycarbonylamino]pentanoic acid CAS Name: (2S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-5-[[(4-nitrophenyl)methoxy-oxomethyl]amino]pentanoic acid IUPAC Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-[(4-nitrophenyl)methoxycarbonylamino]pentanoic acid Traditional Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-[(4-nitrobenzyl)oxycarbonylamino]valeric acid Formula: C28H27N3O8 MolecularWeight: 533.52928

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC(CCCNC(=O)OCC4=CC=C(C=C4)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CCCNC(=O)OCC4=CC=C(C=C4)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C28H27N3O8/c32-26(33)25(10-5-15-29-27(34)38-16-18-11-13-19(14-12-18)31(36)37)30-28(35)39-17-24-22-8-3-1-6-20(22)21-7-2-4-9-23(21)24/h1-4,6-9,11-14,24-25H,5,10,15-17H2,(H,29,34)(H,30,35)(H,32,33)/t25-/m0/s1