3-[1-(4-ethylphenyl)propylamino]azepan-2-one

Systemtic Name: 3-[1-(4-ethylphenyl)propylamino]azepan-2-one Openeye Name: 3-[1-(4-ethylphenyl)propylamino]azepan-2-one CAS Name: 3-[1-(4-ethylphenyl)propylamino]-2-azepanone IUPAC Name: 3-[1-(4-ethylphenyl)propylamino]azepan-2-one Traditional Name: 3-[1-(4-ethylphenyl)propylamino]azepan-2-one Formula: C17H26N2O MolecularWeight: 274.40114

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CC)NC2CCCCNC2=O

Isomeric SMILES

CCC1=CC=C(C=C1)C(CC)NC2CCCCNC2=O

InChI

InChI=1S/C17H26N2O/c1-3-13-8-10-14(11-9-13)15(4-2)19-16-7-5-6-12-18-17(16)20/h8-11,15-16,19H,3-7,12H2,1-2H3,(H,18,20)