(2S)-2-[9H-fluoren-9-ylmethoxycarbonyl(methyl)amino]-4-(phenylmethoxycarbonylamino)butanoic acid

Systemtic Name: (2S)-2-[9H-fluoren-9-ylmethoxycarbonyl(methyl)amino]-4-(phenylmethoxycarbonylamino)butanoic acid Openeye Name: (2S)-4-(benzyloxycarbonylamino)-2-[9H-fluoren-9-ylmethoxycarbonyl(methyl)amino]butanoic acid CAS Name: (2S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]-methylamino]-4-(phenylmethoxycarbonylamino)butanoic acid IUPAC Name: (2S)-2-[9H-fluoren-9-ylmethoxycarbonyl(methyl)amino]-4-(phenylmethoxycarbonylamino)butanoic acid Traditional Name: (2S)-4-(benzyloxycarbonylamino)-2-[9H-fluoren-9-ylmethoxycarbonyl(methyl)amino]butyric acid Formula: C28H28N2O6 MolecularWeight: 488.53172

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(CCNC(=O)OCC1=CC=CC=C1)C(=O)O)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

Isomeric SMILES

CN([C@@H](CCNC(=O)OCC1=CC=CC=C1)C(=O)O)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

InChI

InChI=1S/C28H28N2O6/c1-30(25(26(31)32)15-16-29-27(33)35-17-19-9-3-2-4-10-19)28(34)36-18-24-22-13-7-5-11-20(22)21-12-6-8-14-23(21)24/h2-14,24-25H,15-18H2,1H3,(H,29,33)(H,31,32)/t25-/m0/s1