2-(9H-fluoren-9-ylmethoxycarbonylamino)-2-methyl-6-(phenylmethylsulfanyl)hexanoic acid

Systemtic Name: 2-(9H-fluoren-9-ylmethoxycarbonylamino)-2-methyl-6-(phenylmethylsulfanyl)hexanoic acid Openeye Name: 6-benzylsulfanyl-2-(9H-fluoren-9-ylmethoxycarbonylamino)-2-methyl-hexanoic acid CAS Name: 2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-2-methyl-6-(phenylmethylthio)hexanoic acid IUPAC Name: 6-benzylsulfanyl-2-(9H-fluoren-9-ylmethoxycarbonylamino)-2-methylhexanoic acid Traditional Name: 6-(benzylthio)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-2-methyl-hexanoic acid Formula: C29H31NO4S MolecularWeight: 489.62574

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCSCC1=CC=CC=C1)(C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

Isomeric SMILES

CC(CCCCSCC1=CC=CC=C1)(C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

InChI

InChI=1S/C29H31NO4S/c1-29(27(31)32,17-9-10-18-35-20-21-11-3-2-4-12-21)30-28(33)34-19-26-24-15-7-5-13-22(24)23-14-6-8-16-25(23)26/h2-8,11-16,26H,9-10,17-20H2,1H3,(H,30,33)(H,31,32)