methyl 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[2-(4-methylphenyl)sulfonyl-1,3-dihydroisoindol-5-yl]propanoate

Systemtic Name: methyl 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[2-(4-methylphenyl)sulfonyl-1,3-dihydroisoindol-5-yl]propanoate Openeye Name: methyl 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[2-(p-tolylsulfonyl)isoindolin-5-yl]propanoate CAS Name: 2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-3-[2-(4-methylphenyl)sulfonyl-1,3-dihydroisoindol-5-yl]propanoic acid methyl ester IUPAC Name: methyl 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[2-(4-methylphenyl)sulfonyl-1,3-dihydroisoindol-5-yl]propanoate Traditional Name: 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(2-tosylisoindolin-5-yl)propionic acid methyl ester Formula: C34H32N2O6S MolecularWeight: 596.69268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=C(C2)C=C(C=C3)CC(C(=O)OC)NC(=O)OCC4C5=CC=CC=C5C6=CC=CC=C46

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=C(C2)C=C(C=C3)CC(C(=O)OC)NC(=O)OCC4C5=CC=CC=C5C6=CC=CC=C46

InChI

InChI=1S/C34H32N2O6S/c1-22-11-15-26(16-12-22)43(39,40)36-19-24-14-13-23(17-25(24)20-36)18-32(33(37)41-2)35-34(38)42-21-31-29-9-5-3-7-27(29)28-8-4-6-10-30(28)31/h3-17,31-32H,18-21H2,1-2H3,(H,35,38)