(6R)-6-(phenylmethyl)-1,4-oxazepan-4-ium

Systemtic Name: (6R)-6-(phenylmethyl)-1,4-oxazepan-4-ium Openeye Name: (6R)-6-benzyl-1,4-oxazepan-4-ium CAS Name: (6R)-6-(phenylmethyl)-1,4-oxazepan-4-ium IUPAC Name: (6R)-6-benzyl-1,4-oxazepan-4-ium Traditional Name: (6R)-6-benzyl-1,4-oxazepan-4-ium Formula: C12H18NO+ MolecularWeight: 192.27742

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC(C[NH2+]1)CC2=CC=CC=C2

Isomeric SMILES

C1COC[C@@H](C[NH2+]1)CC2=CC=CC=C2

InChI

InChI=1S/C12H17NO/c1-2-4-11(5-3-1)8-12-9-13-6-7-14-10-12/h1-5,12-13H,6-10H2/p+1/t12-/m1/s1