3-[(4-methylphenyl)methylamino]azepan-2-one

Systemtic Name: 3-[(4-methylphenyl)methylamino]azepan-2-one Openeye Name: 3-(p-tolylmethylamino)azepan-2-one CAS Name: 3-[(4-methylphenyl)methylamino]-2-azepanone IUPAC Name: 3-[(4-methylphenyl)methylamino]azepan-2-one Traditional Name: 3-[(4-methylbenzyl)amino]azepan-2-one Formula: C14H20N2O MolecularWeight: 232.3214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2CCCCNC2=O

Isomeric SMILES

CC1=CC=C(C=C1)CNC2CCCCNC2=O

InChI

InChI=1S/C14H20N2O/c1-11-5-7-12(8-6-11)10-16-13-4-2-3-9-15-14(13)17/h5-8,13,16H,2-4,9-10H2,1H3,(H,15,17)