1-[(1R)-1-phenylethyl]-1,4-diazepane-1,4-diium

Systemtic Name: 1-[(1R)-1-phenylethyl]-1,4-diazepane-1,4-diium Openeye Name: 1-[(1R)-1-phenylethyl]-1,4-diazepane-1,4-diium CAS Name: 1-[(1R)-1-phenylethyl]-1,4-diazepane-1,4-diium IUPAC Name: 1-[(1R)-1-phenylethyl]-1,4-diazepane-1,4-diium Traditional Name: 1-[(1R)-1-phenylethyl]-1,4-diazepane-1,4-diium Formula: C13H22N2+2 MolecularWeight: 206.32718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[NH+]2CCC[NH2+]CC2

Isomeric SMILES

C[C@H](C1=CC=CC=C1)[NH+]2CCC[NH2+]CC2

InChI

InChI=1S/C13H20N2/c1-12(13-6-3-2-4-7-13)15-10-5-8-14-9-11-15/h2-4,6-7,12,14H,5,8-11H2,1H3/p+2/t12-/m1/s1