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

Systemtic Name: 1-[1-(4-phenylmethoxyphenyl)-2-pyridin-2-yl-ethyl]-1,4-diazepane Openeye Name: 1-[1-(4-benzyloxyphenyl)-2-(2-pyridyl)ethyl]-1,4-diazepane CAS Name: 1-[1-(4-phenylmethoxyphenyl)-2-(2-pyridinyl)ethyl]-1,4-diazepane IUPAC Name: 1-[1-(4-phenylmethoxyphenyl)-2-pyridin-2-ylethyl]-1,4-diazepane Traditional Name: 1-[1-(4-benzoxyphenyl)-2-(2-pyridyl)ethyl]-1,4-diazepane Formula: C25H29N3O MolecularWeight: 387.51726

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(CC2=CC=CC=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1CNCCN(C1)C(CC2=CC=CC=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C25H29N3O/c1-2-7-21(8-3-1)20-29-24-12-10-22(11-13-24)25(19-23-9-4-5-15-27-23)28-17-6-14-26-16-18-28/h1-5,7-13,15,25-26H,6,14,16-20H2