4-(4-chloranyl-3-methyl-phenoxy)-1-piperidin-1-yl-butan-1-one

Systemtic Name: 4-(4-chloranyl-3-methyl-phenoxy)-1-piperidin-1-yl-butan-1-one Openeye Name: 4-(4-chloro-3-methyl-phenoxy)-1-(1-piperidyl)butan-1-one CAS Name: 4-(4-chloro-3-methylphenoxy)-1-(1-piperidinyl)-1-butanone IUPAC Name: 4-(4-chloro-3-methylphenoxy)-1-piperidin-1-ylbutan-1-one Traditional Name: 4-(4-chloro-3-methyl-phenoxy)-1-piperidino-butan-1-one Formula: C16H22ClNO2 MolecularWeight: 295.80438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCCC(=O)N2CCCCC2)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCCCC(=O)N2CCCCC2)Cl

InChI

InChI=1S/C16H22ClNO2/c1-13-12-14(7-8-15(13)17)20-11-5-6-16(19)18-9-3-2-4-10-18/h7-8,12H,2-6,9-11H2,1H3