1-[1-(3-phenoxyphenyl)pentyl]-1,4-diazepane

Systemtic Name: 1-[1-(3-phenoxyphenyl)pentyl]-1,4-diazepane Openeye Name: 1-[1-(3-phenoxyphenyl)pentyl]-1,4-diazepane CAS Name: 1-[1-(3-phenoxyphenyl)pentyl]-1,4-diazepane IUPAC Name: 1-[1-(3-phenoxyphenyl)pentyl]-1,4-diazepane Traditional Name: 1-[1-(3-phenoxyphenyl)pentyl]-1,4-diazepane Formula: C22H30N2O MolecularWeight: 338.4864

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC(=CC=C1)OC2=CC=CC=C2)N3CCCNCC3

Isomeric SMILES

CCCCC(C1=CC(=CC=C1)OC2=CC=CC=C2)N3CCCNCC3

InChI

InChI=1S/C22H30N2O/c1-2-3-13-22(24-16-8-14-23-15-17-24)19-9-7-12-21(18-19)25-20-10-5-4-6-11-20/h4-7,9-12,18,22-23H,2-3,8,13-17H2,1H3