3-[1-(4-dimethylaminophenyl)ethylamino]azepan-2-one

Systemtic Name: 3-[1-(4-dimethylaminophenyl)ethylamino]azepan-2-one Openeye Name: 3-[1-(4-dimethylaminophenyl)ethylamino]azepan-2-one CAS Name: 3-[1-(4-dimethylaminophenyl)ethylamino]-2-azepanone IUPAC Name: 3-[1-(4-dimethylaminophenyl)ethylamino]azepan-2-one Traditional Name: 3-[1-(4-dimethylaminophenyl)ethylamino]azepan-2-one Formula: C16H25N3O MolecularWeight: 275.3892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25N3O/c1-12(13-7-9-14(10-8-13)19(2)3)18-15-6-4-5-11-17-16(15)20/h7-10,12,15,18H,4-6,11H2,1-3H3,(H,17,20)