1-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]piperazin-4-ium

Systemtic Name: 1-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]piperazin-4-ium Openeye Name: 1-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]piperazin-4-ium CAS Name: 1-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]piperazin-4-ium IUPAC Name: 1-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]piperazin-4-ium Traditional Name: 1-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]piperazin-4-ium Formula: C16H25N2O2+ MolecularWeight: 277.3819

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC2=C(C=C1)OCCO2)N3CC[NH2+]CC3

Isomeric SMILES

CC(C)[C@@H](C1=CC2=C(C=C1)OCCO2)N3CC[NH2+]CC3

InChI

InChI=1S/C16H24N2O2/c1-12(2)16(18-7-5-17-6-8-18)13-3-4-14-15(11-13)20-10-9-19-14/h3-4,11-12,16-17H,5-10H2,1-2H3/p+1/t16-/m0/s1