methyl 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[7-methyl-2-(4-methylphenyl)sulfonyl-1,3-dihydroisoindol-5-yl]propanoate

Systemtic Name: methyl 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[7-methyl-2-(4-methylphenyl)sulfonyl-1,3-dihydroisoindol-5-yl]propanoate Openeye Name: methyl 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[7-methyl-2-(p-tolylsulfonyl)isoindolin-5-yl]propanoate CAS Name: 2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-3-[7-methyl-2-(4-methylphenyl)sulfonyl-1,3-dihydroisoindol-5-yl]propanoic acid methyl ester IUPAC Name: methyl 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[7-methyl-2-(4-methylphenyl)sulfonyl-1,3-dihydroisoindol-5-yl]propanoate Traditional Name: 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(7-methyl-2-tosyl-isoindolin-5-yl)propionic acid methyl ester Formula: C35H34N2O6S MolecularWeight: 610.71926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=CC(=CC(=C3C2)C)CC(C(=O)OC)NC(=O)OCC4C5=CC=CC=C5C6=CC=CC=C46

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=CC(=CC(=C3C2)C)CC(C(=O)OC)NC(=O)OCC4C5=CC=CC=C5C6=CC=CC=C46

InChI

InChI=1S/C35H34N2O6S/c1-22-12-14-26(15-13-22)44(40,41)37-19-25-17-24(16-23(2)31(25)20-37)18-33(34(38)42-3)36-35(39)43-21-32-29-10-6-4-8-27(29)28-9-5-7-11-30(28)32/h4-17,32-33H,18-21H2,1-3H3,(H,36,39)