(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-6-(naphthalen-1-ylsulfonylamino)hexanoic acid

Systemtic Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-6-(naphthalen-1-ylsulfonylamino)hexanoic acid Openeye Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-6-(1-naphthylsulfonylamino)hexanoic acid CAS Name: (2S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-6-(1-naphthalenylsulfonylamino)hexanoic acid IUPAC Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-6-(naphthalen-1-ylsulfonylamino)hexanoic acid Traditional Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-6-(1-naphthylsulfonylamino)hexanoic acid Formula: C31H30N2O6S MolecularWeight: 558.6447

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2S(=O)(=O)NCCCCC(C(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2S(=O)(=O)NCCCC[C@@H](C(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C31H30N2O6S/c34-30(35)28(17-7-8-19-32-40(37,38)29-18-9-11-21-10-1-2-12-22(21)29)33-31(36)39-20-27-25-15-5-3-13-23(25)24-14-4-6-16-26(24)27/h1-6,9-16,18,27-28,32H,7-8,17,19-20H2,(H,33,36)(H,34,35)/t28-/m0/s1