1-(azocan-1-yl)-4-(4-chloranyl-2-methyl-phenoxy)butan-1-one

Systemtic Name: 1-(azocan-1-yl)-4-(4-chloranyl-2-methyl-phenoxy)butan-1-one Openeye Name: 1-(azocan-1-yl)-4-(4-chloro-2-methyl-phenoxy)butan-1-one CAS Name: 1-(1-azocanyl)-4-(4-chloro-2-methylphenoxy)-1-butanone IUPAC Name: 1-(azocan-1-yl)-4-(4-chloro-2-methylphenoxy)butan-1-one Traditional Name: 1-(azocan-1-yl)-4-(4-chloro-2-methyl-phenoxy)butan-1-one Formula: C18H26ClNO2 MolecularWeight: 323.85754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)N2CCCCCCC2

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)N2CCCCCCC2

InChI

InChI=1S/C18H26ClNO2/c1-15-14-16(19)9-10-17(15)22-13-7-8-18(21)20-11-5-3-2-4-6-12-20/h9-10,14H,2-8,11-13H2,1H3