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

Systemtic Name: 6-methyl-3-[[3-[(propan-2-ylamino)methyl]phenyl]methyl]oxan-2-one Openeye Name: 3-[[3-[(isopropylamino)methyl]phenyl]methyl]-6-methyl-tetrahydropyran-2-one CAS Name: 6-methyl-3-[[3-[(propan-2-ylamino)methyl]phenyl]methyl]-2-oxanone IUPAC Name: 6-methyl-3-[[3-[(propan-2-ylamino)methyl]phenyl]methyl]oxan-2-one Traditional Name: 3-[3-[(isopropylamino)methyl]benzyl]-6-methyl-tetrahydropyran-2-one Formula: C17H25NO2 MolecularWeight: 275.3859

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(=O)O1)CC2=CC(=CC=C2)CNC(C)C

Isomeric SMILES

CC1CCC(C(=O)O1)CC2=CC(=CC=C2)CNC(C)C

InChI

InChI=1S/C17H25NO2/c1-12(2)18-11-15-6-4-5-14(9-15)10-16-8-7-13(3)20-17(16)19/h4-6,9,12-13,16,18H,7-8,10-11H2,1-3H3