phenacyl 4-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylsulfanyl-butanoyl]oxymethyl]benzoate

Systemtic Name: phenacyl 4-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylsulfanyl-butanoyl]oxymethyl]benzoate Openeye Name: phenacyl 4-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylsulfanyl-butanoyl]oxymethyl]benzoate CAS Name: 4-[[(2S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-(methylthio)-1-oxobutoxy]methyl]benzoic acid phenacyl ester IUPAC Name: phenacyl 4-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylsulfanylbutanoyl]oxymethyl]benzoate Traditional Name: 4-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-(methylthio)butanoyl]oxymethyl]benzoic acid phenacyl ester Formula: C36H33NO7S MolecularWeight: 623.71472

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)OCC1=CC=C(C=C1)C(=O)OCC(=O)C2=CC=CC=C2)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

Isomeric SMILES

CSCC[C@@H](C(=O)OCC1=CC=C(C=C1)C(=O)OCC(=O)C2=CC=CC=C2)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C36H33NO7S/c1-45-20-19-32(37-36(41)44-22-31-29-13-7-5-11-27(29)28-12-6-8-14-30(28)31)35(40)42-21-24-15-17-26(18-16-24)34(39)43-23-33(38)25-9-3-2-4-10-25/h2-18,31-32H,19-23H2,1H3,(H,37,41)/t32-/m0/s1