(2R)-2-(2,4,5-trimethylphenyl)azepan-1-ium

Systemtic Name: (2R)-2-(2,4,5-trimethylphenyl)azepan-1-ium Openeye Name: (2R)-2-(2,4,5-trimethylphenyl)azepan-1-ium CAS Name: (2R)-2-(2,4,5-trimethylphenyl)azepan-1-ium IUPAC Name: (2R)-2-(2,4,5-trimethylphenyl)azepan-1-ium Traditional Name: (2R)-2-(2,4,5-trimethylphenyl)azepan-1-ium Formula: C15H24N+ MolecularWeight: 218.35776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2CCCCC[NH2+]2)C)C

Isomeric SMILES

CC1=CC(=C(C=C1[C@H]2CCCCC[NH2+]2)C)C

InChI

InChI=1S/C15H23N/c1-11-9-13(3)14(10-12(11)2)15-7-5-4-6-8-16-15/h9-10,15-16H,4-8H2,1-3H3/p+1/t15-/m1/s1