1-[(2,4-dimethylphenyl)-(4-fluorophenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(2,4-dimethylphenyl)-(4-fluorophenyl)methyl]-1,4-diazepane Openeye Name: 1-[(2,4-dimethylphenyl)-(4-fluorophenyl)methyl]-1,4-diazepane CAS Name: 1-[(2,4-dimethylphenyl)-(4-fluorophenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(2,4-dimethylphenyl)-(4-fluorophenyl)methyl]-1,4-diazepane Traditional Name: 1-[(2,4-dimethylphenyl)-(4-fluorophenyl)methyl]-1,4-diazepane Formula: C20H25FN2 MolecularWeight: 312.424303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C2=CC=C(C=C2)F)N3CCCNCC3)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(C2=CC=C(C=C2)F)N3CCCNCC3)C

InChI

InChI=1S/C20H25FN2/c1-15-4-9-19(16(2)14-15)20(17-5-7-18(21)8-6-17)23-12-3-10-22-11-13-23/h4-9,14,20,22H,3,10-13H2,1-2H3