N2,N7-bis(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2,7-dimethyl-octane-2,7-diamine

Systemtic Name: N2,N7-bis(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2,7-dimethyl-octane-2,7-diamine Openeye Name: N2,N7-bis(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2,7-dimethyl-octane-2,7-diamine CAS Name: N2,N7-bis(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2,7-dimethyloctane-2,7-diamine IUPAC Name: 2-N,7-N-bis(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2,7-dimethyloctane-2,7-diamine Traditional Name: 2,3-dihydro-1,4-benzodioxin-3-ylmethyl-[6-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-1,1,6-trimethyl-heptyl]amine Formula: C28H40N2O4 MolecularWeight: 468.6282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCC(C)(C)NCC1COC2=CC=CC=C2O1)NCC3COC4=CC=CC=C4O3

Isomeric SMILES

CC(C)(CCCCC(C)(C)NCC1COC2=CC=CC=C2O1)NCC3COC4=CC=CC=C4O3

InChI

InChI=1S/C28H40N2O4/c1-27(2,29-17-21-19-31-23-11-5-7-13-25(23)33-21)15-9-10-16-28(3,4)30-18-22-20-32-24-12-6-8-14-26(24)34-22/h5-8,11-14,21-22,29-30H,9-10,15-20H2,1-4H3