2-[1,3-benzodioxol-5-ylmethyl-[(2S)-butan-2-yl]sulfamoyl]ethylazanium

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethyl-[(2S)-butan-2-yl]sulfamoyl]ethylazanium Openeye Name: 2-[1,3-benzodioxol-5-ylmethyl-[(1S)-1-methylpropyl]sulfamoyl]ethylammonium CAS Name: 2-[1,3-benzodioxol-5-ylmethyl-[(2S)-butan-2-yl]sulfamoyl]ethylammonium IUPAC Name: 2-[1,3-benzodioxol-5-ylmethyl-[(2S)-butan-2-yl]sulfamoyl]ethylazanium Traditional Name: 2-[[(1S)-1-methylpropyl]-piperonyl-sulfamoyl]ethylammonium Formula: C14H23N2O4S+ MolecularWeight: 315.40842

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC1=CC2=C(C=C1)OCO2)S(=O)(=O)CC[NH3+]

Isomeric SMILES

CC[C@H](C)N(CC1=CC2=C(C=C1)OCO2)S(=O)(=O)CC[NH3+]

InChI

InChI=1S/C14H22N2O4S/c1-3-11(2)16(21(17,18)7-6-15)9-12-4-5-13-14(8-12)20-10-19-13/h4-5,8,11H,3,6-7,9-10,15H2,1-2H3/p+1/t11-/m0/s1