1-[1-(3-ethoxyphenyl)-2-pyridin-2-yl-ethyl]-1,4-diazepane

Systemtic Name: 1-[1-(3-ethoxyphenyl)-2-pyridin-2-yl-ethyl]-1,4-diazepane Openeye Name: 1-[1-(3-ethoxyphenyl)-2-(2-pyridyl)ethyl]-1,4-diazepane CAS Name: 1-[1-(3-ethoxyphenyl)-2-(2-pyridinyl)ethyl]-1,4-diazepane IUPAC Name: 1-[1-(3-ethoxyphenyl)-2-pyridin-2-ylethyl]-1,4-diazepane Traditional Name: 1-[1-m-phenetyl-2-(2-pyridyl)ethyl]-1,4-diazepane Formula: C20H27N3O MolecularWeight: 325.44788

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C(CC2=CC=CC=N2)N3CCCNCC3

Isomeric SMILES

CCOC1=CC=CC(=C1)C(CC2=CC=CC=N2)N3CCCNCC3

InChI

InChI=1S/C20H27N3O/c1-2-24-19-9-5-7-17(15-19)20(16-18-8-3-4-11-22-18)23-13-6-10-21-12-14-23/h3-5,7-9,11,15,20-21H,2,6,10,12-14,16H2,1H3