N-[2-[4-(1,3-benzodioxol-5-yl)butan-2-ylamino]ethyl]methanesulfonamide

Systemtic Name: N-[2-[4-(1,3-benzodioxol-5-yl)butan-2-ylamino]ethyl]methanesulfonamide Openeye Name: N-[2-[[3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]amino]ethyl]methanesulfonamide CAS Name: N-[2-[4-(1,3-benzodioxol-5-yl)butan-2-ylamino]ethyl]methanesulfonamide IUPAC Name: N-[2-[4-(1,3-benzodioxol-5-yl)butan-2-ylamino]ethyl]methanesulfonamide Traditional Name: N-[2-[[3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]amino]ethyl]methanesulfonamide Formula: C14H22N2O4S MolecularWeight: 314.40048

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC2=C(C=C1)OCO2)NCCNS(=O)(=O)C

Isomeric SMILES

CC(CCC1=CC2=C(C=C1)OCO2)NCCNS(=O)(=O)C

InChI

InChI=1S/C14H22N2O4S/c1-11(15-7-8-16-21(2,17)18)3-4-12-5-6-13-14(9-12)20-10-19-13/h5-6,9,11,15-16H,3-4,7-8,10H2,1-2H3