[(2S)-5-methylhexan-2-yl]-(3-propan-2-yloxypropyl)azanium

Systemtic Name: [(2S)-5-methylhexan-2-yl]-(3-propan-2-yloxypropyl)azanium Openeye Name: [(1S)-1,4-dimethylpentyl]-(3-isopropoxypropyl)ammonium CAS Name: [(2S)-5-methylhexan-2-yl]-(3-propan-2-yloxypropyl)ammonium IUPAC Name: [(2S)-5-methylhexan-2-yl]-(3-propan-2-yloxypropyl)azanium Traditional Name: [(1S)-1,4-dimethylpentyl]-(3-isopropoxypropyl)ammonium Formula: C13H30NO+ MolecularWeight: 216.3834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)[NH2+]CCCOC(C)C

Isomeric SMILES

C[C@@H](CCC(C)C)[NH2+]CCCOC(C)C

InChI

InChI=1S/C13H29NO/c1-11(2)7-8-13(5)14-9-6-10-15-12(3)4/h11-14H,6-10H2,1-5H3/p+1/t13-/m0/s1