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

Systemtic Name: N-(phenylmethyl)-1-[6-(phenylsulfonyl)-2,3-dihydro-1,4-benzodioxin-3-yl]methanamine Openeye Name: 1-[6-(benzenesulfonyl)-2,3-dihydro-1,4-benzodioxin-3-yl]-N-benzyl-methanamine CAS Name: 1-[6-(benzenesulfonyl)-2,3-dihydro-1,4-benzodioxin-3-yl]-N-(phenylmethyl)methanamine IUPAC Name: 1-[6-(benzenesulfonyl)-2,3-dihydro-1,4-benzodioxin-3-yl]-N-benzylmethanamine Traditional Name: benzyl-[(6-besyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]amine Formula: C22H21NO4S MolecularWeight: 395.47144

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C(O1)C=CC(=C2)S(=O)(=O)C3=CC=CC=C3)CNCC4=CC=CC=C4

Isomeric SMILES

C1C(OC2=C(O1)C=CC(=C2)S(=O)(=O)C3=CC=CC=C3)CNCC4=CC=CC=C4

InChI

InChI=1S/C22H21NO4S/c24-28(25,19-9-5-2-6-10-19)20-11-12-21-22(13-20)27-18(16-26-21)15-23-14-17-7-3-1-4-8-17/h1-13,18,23H,14-16H2