1-(4-bromophenyl)sulfonyl-4-[(3-methoxyphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-(4-bromophenyl)sulfonyl-4-[(3-methoxyphenyl)methyl]-1,4-diazepane Openeye Name: 1-(4-bromophenyl)sulfonyl-4-[(3-methoxyphenyl)methyl]-1,4-diazepane CAS Name: 1-(4-bromophenyl)sulfonyl-4-[(3-methoxyphenyl)methyl]-1,4-diazepane IUPAC Name: 1-(4-bromophenyl)sulfonyl-4-[(3-methoxyphenyl)methyl]-1,4-diazepane Traditional Name: 1-brosyl-4-m-anisyl-1,4-diazepane Formula: C19H23BrN2O3S MolecularWeight: 439.36652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2CCCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

COC1=CC=CC(=C1)CN2CCCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H23BrN2O3S/c1-25-18-5-2-4-16(14-18)15-21-10-3-11-22(13-12-21)26(23,24)19-8-6-17(20)7-9-19/h2,4-9,14H,3,10-13,15H2,1H3