2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(1R,2S)-2-methylcyclohexyl]azanium

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(1R,2S)-2-methylcyclohexyl]azanium Openeye Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(1R,2S)-2-methylcyclohexyl]ammonium CAS Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(1R,2S)-2-methylcyclohexyl]ammonium IUPAC Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(1R,2S)-2-methylcyclohexyl]azanium Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(1R,2S)-2-methylcyclohexyl]ammonium Formula: C16H24NO2+ MolecularWeight: 262.36726

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1[NH2+]CC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C[C@H]1CCCC[C@H]1[NH2+]CC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C16H23NO2/c1-12-4-2-3-5-14(12)17-11-13-6-7-15-16(10-13)19-9-8-18-15/h6-7,10,12,14,17H,2-5,8-9,11H2,1H3/p+1/t12-,14+/m0/s1