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2-(dibutylamino)-5-piperidin-1-ylsulfonyl-benzoic acid

2-(dibutylamino)-5-piperidin-1-ylsulfonyl-benzoic acid

Systemtic Name:2-(dibutylamino)-5-piperidin-1-ylsulfonyl-benzoic acid
Openeye Name:2-(dibutylamino)-5-(1-piperidylsulfonyl)benzoic acid
CAS Name:2-(dibutylamino)-5-(1-piperidinylsulfonyl)benzoic acid
IUPAC Name:2-(dibutylamino)-5-piperidin-1-ylsulfonylbenzoic acid
Traditional Name:2-(dibutylamino)-5-piperidinosulfonyl-benzoic acid
Formula: C20H32N2O4S
MolecularWeight: 396.54408
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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)O


Isomeric SMILES

CCCCN(CCCC)C1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)O


InChI

InChI=1S/C20H32N2O4S/c1-3-5-12-21(13-6-4-2)19-11-10-17(16-18(19)20(23)24)27(25,26)22-14-8-7-9-15-22/h10-11,16H,3-9,12-15H2,1-2H3,(H,23,24)


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