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

Systemtic Name: 3-[(4-ethylphenyl)methylamino]azepan-2-one Openeye Name: 3-[(4-ethylphenyl)methylamino]azepan-2-one CAS Name: 3-[(4-ethylphenyl)methylamino]-2-azepanone IUPAC Name: 3-[(4-ethylphenyl)methylamino]azepan-2-one Traditional Name: 3-[(4-ethylbenzyl)amino]azepan-2-one Formula: C15H22N2O MolecularWeight: 246.34798

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CNC2CCCCNC2=O

Isomeric SMILES

CCC1=CC=C(C=C1)CNC2CCCCNC2=O

InChI

InChI=1S/C15H22N2O/c1-2-12-6-8-13(9-7-12)11-17-14-5-3-4-10-16-15(14)18/h6-9,14,17H,2-5,10-11H2,1H3,(H,16,18)