(2S)-2-pentan-3-ylazepan-1-ium

Systemtic Name: (2S)-2-pentan-3-ylazepan-1-ium Openeye Name: (2S)-2-(1-ethylpropyl)azepan-1-ium CAS Name: (2S)-2-pentan-3-ylazepan-1-ium IUPAC Name: (2S)-2-pentan-3-ylazepan-1-ium Traditional Name: (2S)-2-(1-ethylpropyl)azepan-1-ium Formula: C11H24N+ MolecularWeight: 170.31496

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1CCCCC[NH2+]1

Isomeric SMILES

CCC(CC)[C@@H]1CCCCC[NH2+]1

InChI

InChI=1S/C11H23N/c1-3-10(4-2)11-8-6-5-7-9-12-11/h10-12H,3-9H2,1-2H3/p+1/t11-/m0/s1