[(1S)-2-azanyl-2-oxidanylidene-1-phenyl-ethyl]-(4-methylpentyl)azanium

Systemtic Name: [(1S)-2-azanyl-2-oxidanylidene-1-phenyl-ethyl]-(4-methylpentyl)azanium Openeye Name: [(1S)-2-amino-2-oxo-1-phenyl-ethyl]-isohexyl-ammonium CAS Name: [(1S)-2-amino-2-oxo-1-phenylethyl]-(4-methylpentyl)ammonium IUPAC Name: [(1S)-2-amino-2-oxo-1-phenylethyl]-(4-methylpentyl)azanium Traditional Name: [(1S)-2-amino-2-keto-1-phenyl-ethyl]-isohexyl-ammonium Formula: C14H23N2O+ MolecularWeight: 235.34522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC[NH2+]C(C1=CC=CC=C1)C(=O)N

Isomeric SMILES

CC(C)CCC[NH2+][C@@H](C1=CC=CC=C1)C(=O)N

InChI

InChI=1S/C14H22N2O/c1-11(2)7-6-10-16-13(14(15)17)12-8-4-3-5-9-12/h3-5,8-9,11,13,16H,6-7,10H2,1-2H3,(H2,15,17)/p+1/t13-/m0/s1