1-(azepan-1-yl)-3-(4-piperidin-1-ylsulfonylphenyl)propan-1-one

Systemtic Name: 1-(azepan-1-yl)-3-(4-piperidin-1-ylsulfonylphenyl)propan-1-one Openeye Name: 1-(azepan-1-yl)-3-[4-(1-piperidylsulfonyl)phenyl]propan-1-one CAS Name: 1-(1-azepanyl)-3-[4-(1-piperidinylsulfonyl)phenyl]-1-propanone IUPAC Name: 1-(azepan-1-yl)-3-(4-piperidin-1-ylsulfonylphenyl)propan-1-one Traditional Name: 1-(azepan-1-yl)-3-(4-piperidinosulfonylphenyl)propan-1-one Formula: C20H30N2O3S MolecularWeight: 378.5288

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

C1CCCN(CC1)C(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H30N2O3S/c23-20(21-14-4-1-2-5-15-21)13-10-18-8-11-19(12-9-18)26(24,25)22-16-6-3-7-17-22/h8-9,11-12H,1-7,10,13-17H2