2-(4-bromanylphenoxy)ethyl 4-methyl-3-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: 2-(4-bromanylphenoxy)ethyl 4-methyl-3-piperidin-1-ylsulfonyl-benzoate Openeye Name: 2-(4-bromophenoxy)ethyl 4-methyl-3-(1-piperidylsulfonyl)benzoate CAS Name: 4-methyl-3-(1-piperidinylsulfonyl)benzoic acid 2-(4-bromophenoxy)ethyl ester IUPAC Name: 2-(4-bromophenoxy)ethyl 4-methyl-3-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-methyl-3-piperidinosulfonyl-benzoic acid 2-(4-bromophenoxy)ethyl ester Formula: C21H24BrNO5S MolecularWeight: 482.38796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCCOC2=CC=C(C=C2)Br)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCCOC2=CC=C(C=C2)Br)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H24BrNO5S/c1-16-5-6-17(15-20(16)29(25,26)23-11-3-2-4-12-23)21(24)28-14-13-27-19-9-7-18(22)8-10-19/h5-10,15H,2-4,11-14H2,1H3