2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(2R)-4-(furan-2-yl)butan-2-yl]azanium

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(2R)-4-(furan-2-yl)butan-2-yl]azanium Openeye Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(1R)-3-(2-furyl)-1-methyl-propyl]ammonium CAS Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(2R)-4-(2-furanyl)butan-2-yl]ammonium IUPAC Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(2R)-4-(furan-2-yl)butan-2-yl]azanium Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(1R)-3-(2-furyl)-1-methyl-propyl]ammonium Formula: C17H22NO3+ MolecularWeight: 288.36148

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CO1)[NH2+]CC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C[C@H](CCC1=CC=CO1)[NH2+]CC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C17H21NO3/c1-13(4-6-15-3-2-8-19-15)18-12-14-5-7-16-17(11-14)21-10-9-20-16/h2-3,5,7-8,11,13,18H,4,6,9-10,12H2,1H3/p+1/t13-/m1/s1