tert-butyl (2S)-4-(benzotriazol-1-yl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxidanylidene-butanoate

Systemtic Name: tert-butyl (2S)-4-(benzotriazol-1-yl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxidanylidene-butanoate Openeye Name: tert-butyl (2S)-4-(benzotriazol-1-yl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxo-butanoate CAS Name: (2S)-4-(1-benzotriazolyl)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-oxobutanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-4-(benzotriazol-1-yl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxobutanoate Traditional Name: (2S)-4-(benzotriazol-1-yl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-keto-butyric acid tert-butyl ester Formula: C29H28N4O5 MolecularWeight: 512.55642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC(=O)N1C2=CC=CC=C2N=N1)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](CC(=O)N1C2=CC=CC=C2N=N1)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C29H28N4O5/c1-29(2,3)38-27(35)24(16-26(34)33-25-15-9-8-14-23(25)31-32-33)30-28(36)37-17-22-20-12-6-4-10-18(20)19-11-5-7-13-21(19)22/h4-15,22,24H,16-17H2,1-3H3,(H,30,36)/t24-/m0/s1