(7-bromanyl-1-benzofuran-2-yl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone

Systemtic Name: (7-bromanyl-1-benzofuran-2-yl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone Openeye Name: (7-bromobenzofuran-2-yl)-[4-(p-tolylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (7-bromo-2-benzofuranyl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone IUPAC Name: (7-bromo-1-benzofuran-2-yl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone Traditional Name: (7-bromobenzofuran-2-yl)-[4-(4-methylbenzyl)-1,4-diazepan-1-yl]methanone Formula: C22H23BrN2O2 MolecularWeight: 427.33422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC4=C(O3)C(=CC=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC4=C(O3)C(=CC=C4)Br

InChI

InChI=1S/C22H23BrN2O2/c1-16-6-8-17(9-7-16)15-24-10-3-11-25(13-12-24)22(26)20-14-18-4-2-5-19(23)21(18)27-20/h2,4-9,14H,3,10-13,15H2,1H3