[(2S)-1-(3-methylbutylamino)-1-oxidanylidene-propan-2-yl]-phenethyl-azanium

Systemtic Name: [(2S)-1-(3-methylbutylamino)-1-oxidanylidene-propan-2-yl]-phenethyl-azanium Openeye Name: [(1S)-2-(isopentylamino)-1-methyl-2-oxo-ethyl]-phenethyl-ammonium CAS Name: [(2S)-1-(3-methylbutylamino)-1-oxopropan-2-yl]-phenethylammonium IUPAC Name: [(2S)-1-(3-methylbutylamino)-1-oxopropan-2-yl]-phenethylazanium Traditional Name: [(1S)-2-(isoamylamino)-2-keto-1-methyl-ethyl]-phenethyl-ammonium Formula: C16H27N2O+ MolecularWeight: 263.39838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C(C)[NH2+]CCC1=CC=CC=C1

Isomeric SMILES

C[C@@H](C(=O)NCCC(C)C)[NH2+]CCC1=CC=CC=C1

InChI

InChI=1S/C16H26N2O/c1-13(2)9-11-18-16(19)14(3)17-12-10-15-7-5-4-6-8-15/h4-8,13-14,17H,9-12H2,1-3H3,(H,18,19)/p+1/t14-/m0/s1