4-[1-(butylamino)propoxy]benzenesulfinic acid

Systemtic Name: 4-[1-(butylamino)propoxy]benzenesulfinic acid Openeye Name: 4-[1-(butylamino)propoxy]benzenesulfinic acid CAS Name: 4-[1-(butylamino)propoxy]benzenesulfinic acid IUPAC Name: 4-[1-(butylamino)propoxy]benzenesulfinic acid Traditional Name: 4-[1-(butylamino)propoxy]benzenesulfinic acid Formula: C13H21NO3S MolecularWeight: 271.37574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(CC)OC1=CC=C(C=C1)S(=O)O

Isomeric SMILES

CCCCNC(CC)OC1=CC=C(C=C1)S(=O)O

InChI

InChI=1S/C13H21NO3S/c1-3-5-10-14-13(4-2)17-11-6-8-12(9-7-11)18(15)16/h6-9,13-14H,3-5,10H2,1-2H3,(H,15,16)