1-[4-chloranyl-2-methyl-6-[4-(quinolin-2-ylmethoxy)butoxymethyl]phenoxy]propan-2-one

Systemtic Name: 1-[4-chloranyl-2-methyl-6-[4-(quinolin-2-ylmethoxy)butoxymethyl]phenoxy]propan-2-one Openeye Name: 1-[4-chloro-2-methyl-6-[4-(2-quinolylmethoxy)butoxymethyl]phenoxy]propan-2-one CAS Name: 1-[4-chloro-2-methyl-6-[4-(2-quinolinylmethoxy)butoxymethyl]phenoxy]-2-propanone IUPAC Name: 1-[4-chloro-2-methyl-6-[4-(quinolin-2-ylmethoxy)butoxymethyl]phenoxy]propan-2-one Traditional Name: 1-[4-chloro-2-methyl-6-[4-(2-quinolylmethoxy)butoxymethyl]phenoxy]acetone Formula: C25H28ClNO4 MolecularWeight: 441.94712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)C)COCCCCOCC2=NC3=CC=CC=C3C=C2)Cl

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)C)COCCCCOCC2=NC3=CC=CC=C3C=C2)Cl

InChI

InChI=1S/C25H28ClNO4/c1-18-13-22(26)14-21(25(18)31-15-19(2)28)16-29-11-5-6-12-30-17-23-10-9-20-7-3-4-8-24(20)27-23/h3-4,7-10,13-14H,5-6,11-12,15-17H2,1-2H3