3-[[3-[(propan-2-ylamino)methyl]phenyl]methyl]oxan-2-one

Systemtic Name: 3-[[3-[(propan-2-ylamino)methyl]phenyl]methyl]oxan-2-one Openeye Name: 3-[[3-[(isopropylamino)methyl]phenyl]methyl]tetrahydropyran-2-one CAS Name: 3-[[3-[(propan-2-ylamino)methyl]phenyl]methyl]-2-oxanone IUPAC Name: 3-[[3-[(propan-2-ylamino)methyl]phenyl]methyl]oxan-2-one Traditional Name: 3-[3-[(isopropylamino)methyl]benzyl]tetrahydropyran-2-one Formula: C16H23NO2 MolecularWeight: 261.35932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC1=CC=CC(=C1)CC2CCCOC2=O

Isomeric SMILES

CC(C)NCC1=CC=CC(=C1)CC2CCCOC2=O

InChI

InChI=1S/C16H23NO2/c1-12(2)17-11-14-6-3-5-13(9-14)10-15-7-4-8-19-16(15)18/h3,5-6,9,12,15,17H,4,7-8,10-11H2,1-2H3