N-methyl-1-[6-(3-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl]methanamine

Systemtic Name: N-methyl-1-[6-(3-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl]methanamine Openeye Name: N-methyl-1-[6-(m-tolylsulfonyl)-2,3-dihydro-1,4-benzodioxin-3-yl]methanamine CAS Name: N-methyl-1-[6-(3-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl]methanamine IUPAC Name: N-methyl-1-[6-(3-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl]methanamine Traditional Name: methyl-[[6-(m-tolylsulfonyl)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]amine Formula: C17H19NO4S MolecularWeight: 333.40206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)C2=CC3=C(C=C2)OCC(O3)CNC

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)C2=CC3=C(C=C2)OCC(O3)CNC

InChI

InChI=1S/C17H19NO4S/c1-12-4-3-5-14(8-12)23(19,20)15-6-7-16-17(9-15)22-13(10-18-2)11-21-16/h3-9,13,18H,10-11H2,1-2H3