1-[(3-phenoxyphenyl)-pyridin-2-yl-methyl]-1,4-diazepane

Systemtic Name: 1-[(3-phenoxyphenyl)-pyridin-2-yl-methyl]-1,4-diazepane Openeye Name: 1-[(3-phenoxyphenyl)-(2-pyridyl)methyl]-1,4-diazepane CAS Name: 1-[(3-phenoxyphenyl)-(2-pyridinyl)methyl]-1,4-diazepane IUPAC Name: 1-[(3-phenoxyphenyl)-pyridin-2-ylmethyl]-1,4-diazepane Traditional Name: 1-[(3-phenoxyphenyl)-(2-pyridyl)methyl]-1,4-diazepane Formula: C23H25N3O MolecularWeight: 359.4641

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(C2=CC(=CC=C2)OC3=CC=CC=C3)C4=CC=CC=N4

Isomeric SMILES

C1CNCCN(C1)C(C2=CC(=CC=C2)OC3=CC=CC=C3)C4=CC=CC=N4

InChI

InChI=1S/C23H25N3O/c1-2-9-20(10-3-1)27-21-11-6-8-19(18-21)23(22-12-4-5-14-25-22)26-16-7-13-24-15-17-26/h1-6,8-12,14,18,23-24H,7,13,15-17H2