1-[1-(4-ethylphenyl)-2-pyridin-2-yl-ethyl]-1,4-diazepane

Systemtic Name: 1-[1-(4-ethylphenyl)-2-pyridin-2-yl-ethyl]-1,4-diazepane Openeye Name: 1-[1-(4-ethylphenyl)-2-(2-pyridyl)ethyl]-1,4-diazepane CAS Name: 1-[1-(4-ethylphenyl)-2-(2-pyridinyl)ethyl]-1,4-diazepane IUPAC Name: 1-[1-(4-ethylphenyl)-2-pyridin-2-ylethyl]-1,4-diazepane Traditional Name: 1-[1-(4-ethylphenyl)-2-(2-pyridyl)ethyl]-1,4-diazepane Formula: C20H27N3 MolecularWeight: 309.44848

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CC2=CC=CC=N2)N3CCCNCC3

Isomeric SMILES

CCC1=CC=C(C=C1)C(CC2=CC=CC=N2)N3CCCNCC3

InChI

InChI=1S/C20H27N3/c1-2-17-7-9-18(10-8-17)20(16-19-6-3-4-12-22-19)23-14-5-11-21-13-15-23/h3-4,6-10,12,20-21H,2,5,11,13-16H2,1H3