N-[[6-(phenylsulfonyl)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]propan-2-amine

Systemtic Name: N-[[6-(phenylsulfonyl)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]propan-2-amine Openeye Name: N-[[6-(benzenesulfonyl)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]propan-2-amine CAS Name: N-[[6-(benzenesulfonyl)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-propanamine IUPAC Name: N-[[6-(benzenesulfonyl)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]propan-2-amine Traditional Name: (6-besyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl-isopropyl-amine Formula: C18H21NO4S MolecularWeight: 347.42864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC1COC2=C(O1)C=C(C=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)NCC1COC2=C(O1)C=C(C=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H21NO4S/c1-13(2)19-11-14-12-22-17-9-8-16(10-18(17)23-14)24(20,21)15-6-4-3-5-7-15/h3-10,13-14,19H,11-12H2,1-2H3