[(2R)-1-[(3-azanyl-2-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]-butyl-ethyl-azanium

Systemtic Name: [(2R)-1-[(3-azanyl-2-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]-butyl-ethyl-azanium Openeye Name: [(1R)-2-(3-amino-2-methyl-anilino)-1-methyl-2-oxo-ethyl]-butyl-ethyl-ammonium CAS Name: [(2R)-1-(3-amino-2-methylanilino)-1-oxopropan-2-yl]-butyl-ethylammonium IUPAC Name: [(2R)-1-(3-amino-2-methylanilino)-1-oxopropan-2-yl]-butyl-ethylazanium Traditional Name: [(1R)-2-(3-amino-2-methyl-anilino)-2-keto-1-methyl-ethyl]-butyl-ethyl-ammonium Formula: C16H28N3O+ MolecularWeight: 278.41302

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC)C(C)C(=O)NC1=CC=CC(=C1C)N

Isomeric SMILES

CCCC[NH+](CC)[C@H](C)C(=O)NC1=CC=CC(=C1C)N

InChI

InChI=1S/C16H27N3O/c1-5-7-11-19(6-2)13(4)16(20)18-15-10-8-9-14(17)12(15)3/h8-10,13H,5-7,11,17H2,1-4H3,(H,18,20)/p+1/t13-/m1/s1