(phenylmethyl) (4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-iodanyl-pentanoate

Systemtic Name: (phenylmethyl) (4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-iodanyl-pentanoate Openeye Name: benzyl (4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-iodo-pentanoate CAS Name: (4S)-4-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-5-iodopentanoic acid (phenylmethyl) ester IUPAC Name: benzyl (4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-iodopentanoate Traditional Name: (4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-iodo-valeric acid benzyl ester Formula: C27H26INO4 MolecularWeight: 555.40411

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H26INO4/c28-16-20(14-15-26(30)32-17-19-8-2-1-3-9-19)29-27(31)33-18-25-23-12-6-4-10-21(23)22-11-5-7-13-24(22)25/h1-13,20,25H,14-18H2,(H,29,31)/t20-/m0/s1