3-[2-chloranyl-6-[[4-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]-5-methyl-hexan-2-one

Systemtic Name: 3-[2-chloranyl-6-[[4-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]-5-methyl-hexan-2-one Openeye Name: 3-[2-chloro-6-[[4-(2-quinolylmethoxy)phenoxy]methyl]phenoxy]-5-methyl-hexan-2-one CAS Name: 3-[2-chloro-6-[[4-(2-quinolinylmethoxy)phenoxy]methyl]phenoxy]-5-methyl-2-hexanone IUPAC Name: 3-[2-chloro-6-[[4-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]-5-methylhexan-2-one Traditional Name: 3-[2-chloro-6-[[4-(2-quinolylmethoxy)phenoxy]methyl]phenoxy]-5-methyl-hexan-2-one Formula: C30H30ClNO4 MolecularWeight: 504.0165

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)C)OC1=C(C=CC=C1Cl)COC2=CC=C(C=C2)OCC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C)CC(C(=O)C)OC1=C(C=CC=C1Cl)COC2=CC=C(C=C2)OCC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C30H30ClNO4/c1-20(2)17-29(21(3)33)36-30-23(8-6-9-27(30)31)18-34-25-13-15-26(16-14-25)35-19-24-12-11-22-7-4-5-10-28(22)32-24/h4-16,20,29H,17-19H2,1-3H3