1-[(2-bromophenyl)-(2,6-dimethoxyphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(2-bromophenyl)-(2,6-dimethoxyphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(2-bromophenyl)-(2,6-dimethoxyphenyl)methyl]-1,4-diazepane CAS Name: 1-[(2-bromophenyl)-(2,6-dimethoxyphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(2-bromophenyl)-(2,6-dimethoxyphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(2-bromophenyl)-(2,6-dimethoxyphenyl)methyl]-1,4-diazepane Formula: C20H25BrN2O2 MolecularWeight: 405.3287

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(C2=CC=CC=C2Br)N3CCCNCC3

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(C2=CC=CC=C2Br)N3CCCNCC3

InChI

InChI=1S/C20H25BrN2O2/c1-24-17-9-5-10-18(25-2)19(17)20(15-7-3-4-8-16(15)21)23-13-6-11-22-12-14-23/h3-5,7-10,20,22H,6,11-14H2,1-2H3