phenacyl (2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-sulfanyl-propanoate

Systemtic Name: phenacyl (2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-sulfanyl-propanoate Openeye Name: phenacyl (2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-sulfanyl-propanoate CAS Name: (2R)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-3-mercaptopropanoic acid phenacyl ester IUPAC Name: phenacyl (2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-sulfanylpropanoate Traditional Name: (2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-mercapto-propionic acid phenacyl ester Formula: C26H23NO5S MolecularWeight: 461.52952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)COC(=O)C(CS)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

Isomeric SMILES

C1=CC=C(C=C1)C(=O)COC(=O)[C@H](CS)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

InChI

InChI=1S/C26H23NO5S/c28-24(17-8-2-1-3-9-17)15-31-25(29)23(16-33)27-26(30)32-14-22-20-12-6-4-10-18(20)19-11-5-7-13-21(19)22/h1-13,22-23,33H,14-16H2,(H,27,30)/t23-/m0/s1