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

Systemtic Name: N-methyl-1-[(3S)-6-(phenylsulfonyl)-2,3-dihydro-1,4-benzodioxin-3-yl]methanamine Openeye Name: 1-[(3S)-6-(benzenesulfonyl)-2,3-dihydro-1,4-benzodioxin-3-yl]-N-methyl-methanamine CAS Name: 1-[(3S)-6-(benzenesulfonyl)-2,3-dihydro-1,4-benzodioxin-3-yl]-N-methylmethanamine IUPAC Name: 1-[(3S)-6-(benzenesulfonyl)-2,3-dihydro-1,4-benzodioxin-3-yl]-N-methylmethanamine Traditional Name: [(3S)-6-besyl-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-methyl-amine Formula: C16H17NO4S MolecularWeight: 319.37548

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1COC2=C(O1)C=C(C=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CNC[C@H]1COC2=C(O1)C=C(C=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H17NO4S/c1-17-10-12-11-20-15-8-7-14(9-16(15)21-12)22(18,19)13-5-3-2-4-6-13/h2-9,12,17H,10-11H2,1H3/t12-/m0/s1