benzotriazol-1-yl (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-methyl-butanoate

Systemtic Name: benzotriazol-1-yl (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-methyl-butanoate Openeye Name: benzotriazol-1-yl (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-methyl-butanoate CAS Name: (2S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-3-methylbutanoic acid 1-benzotriazolyl ester IUPAC Name: benzotriazol-1-yl (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-methylbutanoate Traditional Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-methyl-butyric acid benzotriazol-1-yl ester Formula: C26H24N4O4 MolecularWeight: 456.49316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)ON1C2=CC=CC=C2N=N1)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

Isomeric SMILES

CC(C)[C@@H](C(=O)ON1C2=CC=CC=C2N=N1)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C26H24N4O4/c1-16(2)24(25(31)34-30-23-14-8-7-13-22(23)28-29-30)27-26(32)33-15-21-19-11-5-3-9-17(19)18-10-4-6-12-20(18)21/h3-14,16,21,24H,15H2,1-2H3,(H,27,32)/t24-/m0/s1