O1-tert-butyl O5-(4-oxidanylidene-1,2,3-benzotriazin-3-yl) (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)pentanedioate

Systemtic Name: O1-tert-butyl O5-(4-oxidanylidene-1,2,3-benzotriazin-3-yl) (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)pentanedioate Openeye Name: O1-tert-butyl O5-(4-oxo-1,2,3-benzotriazin-3-yl) (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)pentanedioate CAS Name: (2S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]pentanedioic acid O1-tert-butyl ester O5-(4-oxo-1,2,3-benzotriazin-3-yl) ester IUPAC Name: 1-O-tert-butyl 5-O-(4-oxo-1,2,3-benzotriazin-3-yl) (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)pentanedioate Traditional Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)glutaric acid O1-tert-butyl ester O5-(4-keto-1,2,3-benzotriazin-3-yl) ester Formula: C31H30N4O7 MolecularWeight: 570.5925

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCC(=O)ON1C(=O)C2=CC=CC=C2N=N1)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](CCC(=O)ON1C(=O)C2=CC=CC=C2N=N1)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C31H30N4O7/c1-31(2,3)41-29(38)26(16-17-27(36)42-35-28(37)23-14-8-9-15-25(23)33-34-35)32-30(39)40-18-24-21-12-6-4-10-19(21)20-11-5-7-13-22(20)24/h4-15,24,26H,16-18H2,1-3H3,(H,32,39)/t26-/m0/s1