3-[[2,6-di(propan-2-yl)phenyl]-ethyl-amino]propylazanium

Systemtic Name: 3-[[2,6-di(propan-2-yl)phenyl]-ethyl-amino]propylazanium Openeye Name: 3-(N-ethyl-2,6-diisopropyl-anilino)propylammonium CAS Name: 3-[N-ethyl-2,6-di(propan-2-yl)anilino]propylammonium IUPAC Name: 3-[N-ethyl-2,6-di(propan-2-yl)anilino]propylazanium Traditional Name: 3-(N-ethyl-2,6-diisopropyl-anilino)propylammonium Formula: C17H31N2+ MolecularWeight: 263.44144

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCC[NH3+])C1=C(C=CC=C1C(C)C)C(C)C

Isomeric SMILES

CCN(CCC[NH3+])C1=C(C=CC=C1C(C)C)C(C)C

InChI

InChI=1S/C17H30N2/c1-6-19(12-8-11-18)17-15(13(2)3)9-7-10-16(17)14(4)5/h7,9-10,13-14H,6,8,11-12,18H2,1-5H3/p+1