3-[(4-aminophenyl)methyl-ethyl-amino]azepan-2-one

Systemtic Name: 3-[(4-aminophenyl)methyl-ethyl-amino]azepan-2-one Openeye Name: 3-[(4-aminophenyl)methyl-ethyl-amino]azepan-2-one CAS Name: 3-[(4-aminophenyl)methyl-ethylamino]-2-azepanone IUPAC Name: 3-[(4-aminophenyl)methyl-ethylamino]azepan-2-one Traditional Name: 3-[(4-aminobenzyl)-ethyl-amino]azepan-2-one Formula: C15H23N3O MolecularWeight: 261.36262

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(C=C1)N)C2CCCCNC2=O

Isomeric SMILES

CCN(CC1=CC=C(C=C1)N)C2CCCCNC2=O

InChI

InChI=1S/C15H23N3O/c1-2-18(11-12-6-8-13(16)9-7-12)14-5-3-4-10-17-15(14)19/h6-9,14H,2-5,10-11,16H2,1H3,(H,17,19)