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methanol; 2-(methylsulfonylmethyl)-4-(1-piperidin-3-ylbutyl)phenol; hydrobromide

methanol; 2-(methylsulfonylmethyl)-4-(1-piperidin-3-ylbutyl)phenol; hydrobromide

Systemtic Name:methanol; 2-(methylsulfonylmethyl)-4-(1-piperidin-3-ylbutyl)phenol; hydrobromide
Openeye Name:methanol; 2-(methylsulfonylmethyl)-4-[1-(3-piperidyl)butyl]phenol; hydrobromide
CAS Name:methanol; 2-(methylsulfonylmethyl)-4-[1-(3-piperidinyl)butyl]phenol; hydrobromide
IUPAC Name:methanol; 2-(methylsulfonylmethyl)-4-(1-piperidin-3-ylbutyl)phenol; hydrobromide
Traditional Name:2-(mesylmethyl)-4-[1-(3-piperidyl)butyl]phenol; methanol; hydrobromide
Formula: C18H32BrNO4S
MolecularWeight: 438.41998
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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1CCCNC1)C2=CC(=C(C=C2)O)CS(=O)(=O)C.CO.Br


Isomeric SMILES

CCCC(C1CCCNC1)C2=CC(=C(C=C2)O)CS(=O)(=O)C.CO.Br


InChI

InChI=1S/C17H27NO3S.CH4O.BrH/c1-3-5-16(14-6-4-9-18-11-14)13-7-8-17(19)15(10-13)12-22(2,20)21;1-2;/h7-8,10,14,16,18-19H,3-6,9,11-12H2,1-2H3;2H,1H3;1H


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