(2S)-3-(1-benzothiophen-3-yl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoate

Systemtic Name: (2S)-3-(1-benzothiophen-3-yl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoate Openeye Name: (2S)-3-(benzothiophen-3-yl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoate CAS Name: (2S)-3-(1-benzothiophen-3-yl)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]propanoate IUPAC Name: (2S)-3-(1-benzothiophen-3-yl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoate Traditional Name: (2S)-3-(benzothiophen-3-yl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propionate Formula: C26H20NO4S- MolecularWeight: 442.5063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC(CC4=CSC5=CC=CC=C54)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC4=CSC5=CC=CC=C54)C(=O)[O-]

InChI

InChI=1S/C26H21NO4S/c28-25(29)23(13-16-15-32-24-12-6-5-7-17(16)24)27-26(30)31-14-22-20-10-3-1-8-18(20)19-9-2-4-11-21(19)22/h1-12,15,22-23H,13-14H2,(H,27,30)(H,28,29)/p-1/t23-/m0/s1