4-[[5-(5-ethylsulfonyl-2-methoxy-phenyl)-1H-pyrrol-2-yl]methyl]-4-azabicyclo[3.2.1]octane

Systemtic Name: 4-[[5-(5-ethylsulfonyl-2-methoxy-phenyl)-1H-pyrrol-2-yl]methyl]-4-azabicyclo[3.2.1]octane Openeye Name: 4-[[5-(5-ethylsulfonyl-2-methoxy-phenyl)-1H-pyrrol-2-yl]methyl]-4-azabicyclo[3.2.1]octane CAS Name: 4-[[5-(5-ethylsulfonyl-2-methoxyphenyl)-1H-pyrrol-2-yl]methyl]-4-azabicyclo[3.2.1]octane IUPAC Name: 4-[[5-(5-ethylsulfonyl-2-methoxyphenyl)-1H-pyrrol-2-yl]methyl]-4-azabicyclo[3.2.1]octane Traditional Name: 4-[[5-(5-esyl-2-methoxy-phenyl)-1H-pyrrol-2-yl]methyl]-4-azabicyclo[3.2.1]octane Formula: C21H28N2O3S MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=C(C=C1)OC)C2=CC=C(N2)CN3CCC4CCC3C4

Isomeric SMILES

CCS(=O)(=O)C1=CC(=C(C=C1)OC)C2=CC=C(N2)CN3CCC4CCC3C4

InChI

InChI=1S/C21H28N2O3S/c1-3-27(24,25)18-7-9-21(26-2)19(13-18)20-8-5-16(22-20)14-23-11-10-15-4-6-17(23)12-15/h5,7-9,13,15,17,22H,3-4,6,10-12,14H2,1-2H3