[(2R)-1-(3-methylbutylamino)-1-oxidanylidene-propan-2-yl]-pentan-3-yl-azanium

Systemtic Name: [(2R)-1-(3-methylbutylamino)-1-oxidanylidene-propan-2-yl]-pentan-3-yl-azanium Openeye Name: 1-ethylpropyl-[(1R)-2-(isopentylamino)-1-methyl-2-oxo-ethyl]ammonium CAS Name: [(2R)-1-(3-methylbutylamino)-1-oxopropan-2-yl]-pentan-3-ylammonium IUPAC Name: [(2R)-1-(3-methylbutylamino)-1-oxopropan-2-yl]-pentan-3-ylazanium Traditional Name: 1-ethylpropyl-[(1R)-2-(isoamylamino)-2-keto-1-methyl-ethyl]ammonium Formula: C13H29N2O+ MolecularWeight: 229.38216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)[NH2+]C(C)C(=O)NCCC(C)C

Isomeric SMILES

CCC(CC)[NH2+][C@H](C)C(=O)NCCC(C)C

InChI

InChI=1S/C13H28N2O/c1-6-12(7-2)15-11(5)13(16)14-9-8-10(3)4/h10-12,15H,6-9H2,1-5H3,(H,14,16)/p+1/t11-/m1/s1