1-(azepan-1-yl)-3-(4-bromophenyl)sulfonyl-propan-1-one

Systemtic Name: 1-(azepan-1-yl)-3-(4-bromophenyl)sulfonyl-propan-1-one Openeye Name: 1-(azepan-1-yl)-3-(4-bromophenyl)sulfonyl-propan-1-one CAS Name: 1-(1-azepanyl)-3-(4-bromophenyl)sulfonyl-1-propanone IUPAC Name: 1-(azepan-1-yl)-3-(4-bromophenyl)sulfonylpropan-1-one Traditional Name: 1-(azepan-1-yl)-3-brosyl-propan-1-one Formula: C15H20BrNO3S MolecularWeight: 374.2932

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CCS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C1CCCN(CC1)C(=O)CCS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C15H20BrNO3S/c16-13-5-7-14(8-6-13)21(19,20)12-9-15(18)17-10-3-1-2-4-11-17/h5-8H,1-4,9-12H2