6-bromanyl-7-(1-ethylsulfonylpiperidin-4-yl)oxy-isoquinoline

Systemtic Name: 6-bromanyl-7-(1-ethylsulfonylpiperidin-4-yl)oxy-isoquinoline Openeye Name: 6-bromo-7-[(1-ethylsulfonyl-4-piperidyl)oxy]isoquinoline CAS Name: 6-bromo-7-[(1-ethylsulfonyl-4-piperidinyl)oxy]isoquinoline IUPAC Name: 6-bromo-7-(1-ethylsulfonylpiperidin-4-yl)oxyisoquinoline Traditional Name: 6-bromo-7-[(1-esyl-4-piperidyl)oxy]isoquinoline Formula: C16H19BrN2O3S MolecularWeight: 399.30266

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)OC2=C(C=C3C=CN=CC3=C2)Br

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)OC2=C(C=C3C=CN=CC3=C2)Br

InChI

InChI=1S/C16H19BrN2O3S/c1-2-23(20,21)19-7-4-14(5-8-19)22-16-10-13-11-18-6-3-12(13)9-15(16)17/h3,6,9-11,14H,2,4-5,7-8H2,1H3