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

Systemtic Name: 3-[(4-butoxyphenyl)methylamino]azepan-2-one Openeye Name: 3-[(4-butoxyphenyl)methylamino]azepan-2-one CAS Name: 3-[(4-butoxyphenyl)methylamino]-2-azepanone IUPAC Name: 3-[(4-butoxyphenyl)methylamino]azepan-2-one Traditional Name: 3-[(4-butoxybenzyl)amino]azepan-2-one Formula: C17H26N2O2 MolecularWeight: 290.40054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CNC2CCCCNC2=O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CNC2CCCCNC2=O

InChI

InChI=1S/C17H26N2O2/c1-2-3-12-21-15-9-7-14(8-10-15)13-19-16-6-4-5-11-18-17(16)20/h7-10,16,19H,2-6,11-13H2,1H3,(H,18,20)