pentan-3-yl-(phenylmethyl)azanium

Systemtic Name: pentan-3-yl-(phenylmethyl)azanium Openeye Name: benzyl(1-ethylpropyl)ammonium CAS Name: pentan-3-yl-(phenylmethyl)ammonium IUPAC Name: benzyl(pentan-3-yl)azanium Traditional Name: benzyl(1-ethylpropyl)ammonium Formula: C12H20N+ MolecularWeight: 178.2939

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)[NH2+]CC1=CC=CC=C1

Isomeric SMILES

CCC(CC)[NH2+]CC1=CC=CC=C1

InChI

InChI=1S/C12H19N/c1-3-12(4-2)13-10-11-8-6-5-7-9-11/h5-9,12-13H,3-4,10H2,1-2H3/p+1