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5-azanyl-2-(butylamino)benzenesulfonic acid

5-azanyl-2-(butylamino)benzenesulfonic acid

Systemtic Name:5-azanyl-2-(butylamino)benzenesulfonic acid
Openeye Name:5-amino-2-(butylamino)benzenesulfonic acid
CAS Name:5-amino-2-(butylamino)benzenesulfonic acid
IUPAC Name:5-amino-2-(butylamino)benzenesulfonic acid
Traditional Name:5-amino-2-(butylamino)besylic acid
Formula: C10H16N2O3S
MolecularWeight: 244.31064
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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C=C(C=C1)N)S(=O)(=O)O


Isomeric SMILES

CCCCNC1=C(C=C(C=C1)N)S(=O)(=O)O


InChI

InChI=1S/C10H16N2O3S/c1-2-3-6-12-9-5-4-8(11)7-10(9)16(13,14)15/h4-5,7,12H,2-3,6,11H2,1H3,(H,13,14,15)


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