1-[[5-(3-bromanyl-5-ethylsulfonyl-2-methoxy-phenyl)-1H-pyrrol-2-yl]methyl]piperidine

Systemtic Name: 1-[[5-(3-bromanyl-5-ethylsulfonyl-2-methoxy-phenyl)-1H-pyrrol-2-yl]methyl]piperidine Openeye Name: 1-[[5-(3-bromo-5-ethylsulfonyl-2-methoxy-phenyl)-1H-pyrrol-2-yl]methyl]piperidine CAS Name: 1-[[5-(3-bromo-5-ethylsulfonyl-2-methoxyphenyl)-1H-pyrrol-2-yl]methyl]piperidine IUPAC Name: 1-[[5-(3-bromo-5-ethylsulfonyl-2-methoxyphenyl)-1H-pyrrol-2-yl]methyl]piperidine Traditional Name: 1-[[5-(3-bromo-5-esyl-2-methoxy-phenyl)-1H-pyrrol-2-yl]methyl]piperidine Formula: C19H25BrN2O3S MolecularWeight: 441.3824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=C(C(=C1)C2=CC=C(N2)CN3CCCCC3)OC)Br

Isomeric SMILES

CCS(=O)(=O)C1=CC(=C(C(=C1)C2=CC=C(N2)CN3CCCCC3)OC)Br

InChI

InChI=1S/C19H25BrN2O3S/c1-3-26(23,24)15-11-16(19(25-2)17(20)12-15)18-8-7-14(21-18)13-22-9-5-4-6-10-22/h7-8,11-12,21H,3-6,9-10,13H2,1-2H3