4,7-diethyl-5-[(2-methoxyphenyl)methyl]-2-(4-methylphenyl)sulfonyl-1,3-dihydroisoindole

Systemtic Name: 4,7-diethyl-5-[(2-methoxyphenyl)methyl]-2-(4-methylphenyl)sulfonyl-1,3-dihydroisoindole Openeye Name: 4,7-diethyl-5-[(2-methoxyphenyl)methyl]-2-(p-tolylsulfonyl)isoindoline CAS Name: 4,7-diethyl-5-[(2-methoxyphenyl)methyl]-2-(4-methylphenyl)sulfonyl-1,3-dihydroisoindole IUPAC Name: 4,7-diethyl-5-[(2-methoxyphenyl)methyl]-2-(4-methylphenyl)sulfonyl-1,3-dihydroisoindole Traditional Name: 4,7-diethyl-5-o-anisyl-2-tosyl-isoindoline Formula: C27H31NO3S MolecularWeight: 449.60494

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C2=C1CN(C2)S(=O)(=O)C3=CC=C(C=C3)C)CC)CC4=CC=CC=C4OC

Isomeric SMILES

CCC1=CC(=C(C2=C1CN(C2)S(=O)(=O)C3=CC=C(C=C3)C)CC)CC4=CC=CC=C4OC

InChI

InChI=1S/C27H31NO3S/c1-5-20-15-22(16-21-9-7-8-10-27(21)31-4)24(6-2)26-18-28(17-25(20)26)32(29,30)23-13-11-19(3)12-14-23/h7-15H,5-6,16-18H2,1-4H3