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

Systemtic Name: 3-[1-(4-propan-2-ylphenyl)ethylamino]azepan-2-one Openeye Name: 3-[1-(4-isopropylphenyl)ethylamino]azepan-2-one CAS Name: 3-[1-(4-propan-2-ylphenyl)ethylamino]-2-azepanone IUPAC Name: 3-[1-(4-propan-2-ylphenyl)ethylamino]azepan-2-one Traditional Name: 3-(1-p-cumenylethylamino)azepan-2-one Formula: C17H26N2O MolecularWeight: 274.40114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N2O/c1-12(2)14-7-9-15(10-8-14)13(3)19-16-6-4-5-11-18-17(16)20/h7-10,12-13,16,19H,4-6,11H2,1-3H3,(H,18,20)