(2S,3S)-3-(4-cyanophenyl)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-2-oxidanyl-propanoic acid

Systemtic Name: (2S,3S)-3-(4-cyanophenyl)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-2-oxidanyl-propanoic acid Openeye Name: (2S,3S)-3-(4-cyanophenyl)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-2-hydroxy-propanoic acid CAS Name: (2S,3S)-3-(4-cyanophenyl)-3-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-2-hydroxypropanoic acid IUPAC Name: (2S,3S)-3-(4-cyanophenyl)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-2-hydroxypropanoic acid Traditional Name: (2S,3S)-3-(4-cyanophenyl)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-2-hydroxy-propionic acid Formula: C25H20N2O5 MolecularWeight: 428.4367

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC(C4=CC=C(C=C4)C#N)C(C(=O)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](C4=CC=C(C=C4)C#N)[C@@H](C(=O)O)O

InChI

InChI=1S/C25H20N2O5/c26-13-15-9-11-16(12-10-15)22(23(28)24(29)30)27-25(31)32-14-21-19-7-3-1-5-17(19)18-6-2-4-8-20(18)21/h1-12,21-23,28H,14H2,(H,27,31)(H,29,30)/t22-,23-/m0/s1