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2-[(pentylsulfonylamino)methyl]benzoic acid

2-[(pentylsulfonylamino)methyl]benzoic acid

Systemtic Name:2-[(pentylsulfonylamino)methyl]benzoic acid
Openeye Name:2-[(pentylsulfonylamino)methyl]benzoic acid
CAS Name:2-[(pentylsulfonylamino)methyl]benzoic acid
IUPAC Name:2-[(pentylsulfonylamino)methyl]benzoic acid
Traditional Name:2-[(amylsulfonylamino)methyl]benzoic acid
Formula: C13H19NO4S
MolecularWeight: 285.35926
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCS(=O)(=O)NCC1=CC=CC=C1C(=O)O


Isomeric SMILES

CCCCCS(=O)(=O)NCC1=CC=CC=C1C(=O)O


InChI

InChI=1S/C13H19NO4S/c1-2-3-6-9-19(17,18)14-10-11-7-4-5-8-12(11)13(15)16/h4-5,7-8,14H,2-3,6,9-10H2,1H3,(H,15,16)


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