tert-butyl (2S)-2-[9H-fluoren-9-ylmethoxycarbonyl-[3-(prop-2-enoxycarbonylamino)propyl]amino]-3-methyl-butanoate

Systemtic Name: tert-butyl (2S)-2-[9H-fluoren-9-ylmethoxycarbonyl-[3-(prop-2-enoxycarbonylamino)propyl]amino]-3-methyl-butanoate Openeye Name: tert-butyl (2S)-2-[3-(allyloxycarbonylamino)propyl-(9H-fluoren-9-ylmethoxycarbonyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]-[3-[[oxo(prop-2-enoxy)methyl]amino]propyl]amino]-3-methylbutanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[9H-fluoren-9-ylmethoxycarbonyl-[3-(prop-2-enoxycarbonylamino)propyl]amino]-3-methylbutanoate Traditional Name: (2S)-2-[3-(allyloxycarbonylamino)propyl-(9H-fluoren-9-ylmethoxycarbonyl)amino]-3-methyl-butyric acid tert-butyl ester Formula: C31H40N2O6 MolecularWeight: 536.6591

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC(C)(C)C)N(CCCNC(=O)OCC=C)C(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13

Isomeric SMILES

CC(C)[C@@H](C(=O)OC(C)(C)C)N(CCCNC(=O)OCC=C)C(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13

InChI

InChI=1S/C31H40N2O6/c1-7-19-37-29(35)32-17-12-18-33(27(21(2)3)28(34)39-31(4,5)6)30(36)38-20-26-24-15-10-8-13-22(24)23-14-9-11-16-25(23)26/h7-11,13-16,21,26-27H,1,12,17-20H2,2-6H3,(H,32,35)/t27-/m0/s1