(phenylmethyl) 2-[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethylsulfanyl]ethanoate

Systemtic Name: (phenylmethyl) 2-[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethylsulfanyl]ethanoate Openeye Name: benzyl 2-[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethylsulfanyl]acetate CAS Name: 2-[2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]ethylthio]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethylsulfanyl]acetate Traditional Name: 2-[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethylthio]acetic acid benzyl ester Formula: C26H25NO4S MolecularWeight: 447.546

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CSCCNC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CSCCNC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

InChI

InChI=1S/C26H25NO4S/c28-25(30-16-19-8-2-1-3-9-19)18-32-15-14-27-26(29)31-17-24-22-12-6-4-10-20(22)21-11-5-7-13-23(21)24/h1-13,24H,14-18H2,(H,27,29)