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

Systemtic Name: 5-methyl-3-[2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]hexan-2-one Openeye Name: 5-methyl-3-[2-[[3-(2-quinolylmethoxy)phenoxy]methyl]phenoxy]hexan-2-one CAS Name: 5-methyl-3-[2-[[3-(2-quinolinylmethoxy)phenoxy]methyl]phenoxy]-2-hexanone IUPAC Name: 5-methyl-3-[2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]hexan-2-one Traditional Name: 5-methyl-3-[2-[[3-(2-quinolylmethoxy)phenoxy]methyl]phenoxy]hexan-2-one Formula: C30H31NO4 MolecularWeight: 469.57144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)C)OC1=CC=CC=C1COC2=CC(=CC=C2)OCC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C)CC(C(=O)C)OC1=CC=CC=C1COC2=CC(=CC=C2)OCC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C30H31NO4/c1-21(2)17-30(22(3)32)35-29-14-7-5-10-24(29)19-33-26-11-8-12-27(18-26)34-20-25-16-15-23-9-4-6-13-28(23)31-25/h4-16,18,21,30H,17,19-20H2,1-3H3