3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-[4-(4-methylphenyl)sulfonyloxyphenyl]butanoic acid

Systemtic Name: 3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-[4-(4-methylphenyl)sulfonyloxyphenyl]butanoic acid Openeye Name: 3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-[4-(p-tolylsulfonyloxy)phenyl]butanoic acid CAS Name: 3-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-[4-(4-methylphenyl)sulfonyloxyphenyl]butanoic acid IUPAC Name: 3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-[4-(4-methylphenyl)sulfonyloxyphenyl]butanoic acid Traditional Name: 3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-(4-tosyloxyphenyl)butyric acid Formula: C32H29NO7S MolecularWeight: 571.64016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)CC(CC(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)CC(CC(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C32H29NO7S/c1-21-10-16-25(17-11-21)41(37,38)40-24-14-12-22(13-15-24)18-23(19-31(34)35)33-32(36)39-20-30-28-8-4-2-6-26(28)27-7-3-5-9-29(27)30/h2-17,23,30H,18-20H2,1H3,(H,33,36)(H,34,35)