(4-methylphenyl) 3-[[7-(9H-fluoren-9-ylmethoxycarbonylamino)naphthalen-2-yl]carbonylamino]benzenesulfonate

Systemtic Name: (4-methylphenyl) 3-[[7-(9H-fluoren-9-ylmethoxycarbonylamino)naphthalen-2-yl]carbonylamino]benzenesulfonate Openeye Name: p-tolyl 3-[[7-(9H-fluoren-9-ylmethoxycarbonylamino)naphthalene-2-carbonyl]amino]benzenesulfonate CAS Name: 3-[[[7-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-2-naphthalenyl]-oxomethyl]amino]benzenesulfonic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 3-[[7-(9H-fluoren-9-ylmethoxycarbonylamino)naphthalene-2-carbonyl]amino]benzenesulfonate Traditional Name: 3-[[7-(9H-fluoren-9-ylmethoxycarbonylamino)-2-naphthoyl]amino]benzenesulfonic acid p-tolyl ester Formula: C39H30N2O6S MolecularWeight: 654.7303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC4=C(C=C3)C=CC(=C4)NC(=O)OCC5C6=CC=CC=C6C7=CC=CC=C57

Isomeric SMILES

CC1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC4=C(C=C3)C=CC(=C4)NC(=O)OCC5C6=CC=CC=C6C7=CC=CC=C57

InChI

InChI=1S/C39H30N2O6S/c1-25-13-19-31(20-14-25)47-48(44,45)32-8-6-7-29(23-32)40-38(42)27-16-15-26-17-18-30(22-28(26)21-27)41-39(43)46-24-37-35-11-4-2-9-33(35)34-10-3-5-12-36(34)37/h2-23,37H,24H2,1H3,(H,40,42)(H,41,43)