6-(2-methylsulfonylpropan-2-yl)-8-[3-[[2-(phenylmethyl)phenoxy]methyl]phenyl]quinoline

Systemtic Name: 6-(2-methylsulfonylpropan-2-yl)-8-[3-[[2-(phenylmethyl)phenoxy]methyl]phenyl]quinoline Openeye Name: 8-[3-[(2-benzylphenoxy)methyl]phenyl]-6-(1-methyl-1-methylsulfonyl-ethyl)quinoline CAS Name: 6-(2-methylsulfonylpropan-2-yl)-8-[3-[[2-(phenylmethyl)phenoxy]methyl]phenyl]quinoline IUPAC Name: 8-[3-[(2-benzylphenoxy)methyl]phenyl]-6-(2-methylsulfonylpropan-2-yl)quinoline Traditional Name: 8-[3-[(2-benzylphenoxy)methyl]phenyl]-6-(1-mesyl-1-methyl-ethyl)quinoline Formula: C33H31NO3S MolecularWeight: 521.66914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)COC4=CC=CC=C4CC5=CC=CC=C5)S(=O)(=O)C

Isomeric SMILES

CC(C)(C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)COC4=CC=CC=C4CC5=CC=CC=C5)S(=O)(=O)C

InChI

InChI=1S/C33H31NO3S/c1-33(2,38(3,35)36)29-21-28-16-10-18-34-32(28)30(22-29)26-15-9-13-25(20-26)23-37-31-17-8-7-14-27(31)19-24-11-5-4-6-12-24/h4-18,20-22H,19,23H2,1-3H3