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

Systemtic Name: 3-[(4-methylphenyl)amino]azepan-2-one Openeye Name: 3-(4-methylanilino)azepan-2-one CAS Name: 3-(4-methylanilino)-2-azepanone IUPAC Name: 3-(4-methylanilino)azepan-2-one Traditional Name: 3-(p-toluidino)azepan-2-one Formula: C13H18N2O MolecularWeight: 218.29482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2CCCCNC2=O

Isomeric SMILES

CC1=CC=C(C=C1)NC2CCCCNC2=O

InChI

InChI=1S/C13H18N2O/c1-10-5-7-11(8-6-10)15-12-4-2-3-9-14-13(12)16/h5-8,12,15H,2-4,9H2,1H3,(H,14,16)