2,2-dibutyl-5-(3-phenylpropyl)-1,4-diazepane

Systemtic Name: 2,2-dibutyl-5-(3-phenylpropyl)-1,4-diazepane Openeye Name: 2,2-dibutyl-5-(3-phenylpropyl)-1,4-diazepane CAS Name: 2,2-dibutyl-5-(3-phenylpropyl)-1,4-diazepane IUPAC Name: 2,2-dibutyl-5-(3-phenylpropyl)-1,4-diazepane Traditional Name: 2,2-dibutyl-5-(3-phenylpropyl)-1,4-diazepane Formula: C22H38N2 MolecularWeight: 330.55052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CNC(CCN1)CCCC2=CC=CC=C2)CCCC

Isomeric SMILES

CCCCC1(CNC(CCN1)CCCC2=CC=CC=C2)CCCC

InChI

InChI=1S/C22H38N2/c1-3-5-16-22(17-6-4-2)19-23-21(15-18-24-22)14-10-13-20-11-8-7-9-12-20/h7-9,11-12,21,23-24H,3-6,10,13-19H2,1-2H3