[3-[2-(9H-fluoren-9-ylmethoxycarbonylamino)butyl]phenyl] 4-methylbenzenesulfonate

Systemtic Name: [3-[2-(9H-fluoren-9-ylmethoxycarbonylamino)butyl]phenyl] 4-methylbenzenesulfonate Openeye Name: [3-[2-(9H-fluoren-9-ylmethoxycarbonylamino)butyl]phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [3-[2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]butyl]phenyl] ester IUPAC Name: [3-[2-(9H-fluoren-9-ylmethoxycarbonylamino)butyl]phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [3-[2-(9H-fluoren-9-ylmethoxycarbonylamino)butyl]phenyl] ester Formula: C32H31NO5S MolecularWeight: 541.65724

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC(=CC=C1)OS(=O)(=O)C2=CC=C(C=C2)C)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

Isomeric SMILES

CCC(CC1=CC(=CC=C1)OS(=O)(=O)C2=CC=C(C=C2)C)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C32H31NO5S/c1-3-24(19-23-9-8-10-25(20-23)38-39(35,36)26-17-15-22(2)16-18-26)33-32(34)37-21-31-29-13-6-4-11-27(29)28-12-5-7-14-30(28)31/h4-18,20,24,31H,3,19,21H2,1-2H3,(H,33,34)