2,2-dibutyl-5-phenethyl-1,4-diazepane

Systemtic Name: 2,2-dibutyl-5-phenethyl-1,4-diazepane Openeye Name: 2,2-dibutyl-5-phenethyl-1,4-diazepane CAS Name: 2,2-dibutyl-5-phenethyl-1,4-diazepane IUPAC Name: 2,2-dibutyl-5-phenethyl-1,4-diazepane Traditional Name: 2,2-dibutyl-5-phenethyl-1,4-diazepane Formula: C21H36N2 MolecularWeight: 316.52394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CNC(CCN1)CCC2=CC=CC=C2)CCCC

Isomeric SMILES

CCCCC1(CNC(CCN1)CCC2=CC=CC=C2)CCCC

InChI

InChI=1S/C21H36N2/c1-3-5-15-21(16-6-4-2)18-22-20(14-17-23-21)13-12-19-10-8-7-9-11-19/h7-11,20,22-23H,3-6,12-18H2,1-2H3