(2R)-2-(1-methylpyrrol-2-yl)azepan-1-ium

Systemtic Name: (2R)-2-(1-methylpyrrol-2-yl)azepan-1-ium Openeye Name: (2R)-2-(1-methylpyrrol-2-yl)azepan-1-ium CAS Name: (2R)-2-(1-methyl-2-pyrrolyl)azepan-1-ium IUPAC Name: (2R)-2-(1-methylpyrrol-2-yl)azepan-1-ium Traditional Name: (2R)-2-(1-methylpyrrol-2-yl)azepan-1-ium Formula: C11H19N2+ MolecularWeight: 179.28196

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2CCCCC[NH2+]2

Isomeric SMILES

CN1C=CC=C1[C@H]2CCCCC[NH2+]2

InChI

InChI=1S/C11H18N2/c1-13-9-5-7-11(13)10-6-3-2-4-8-12-10/h5,7,9-10,12H,2-4,6,8H2,1H3/p+1/t10-/m1/s1