[(2R)-1-[(5-azanyl-2-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]-butyl-methyl-azanium

Systemtic Name: [(2R)-1-[(5-azanyl-2-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]-butyl-methyl-azanium Openeye Name: [(1R)-2-(5-amino-2-methyl-anilino)-1-methyl-2-oxo-ethyl]-butyl-methyl-ammonium CAS Name: [(2R)-1-(5-amino-2-methylanilino)-1-oxopropan-2-yl]-butyl-methylammonium IUPAC Name: [(2R)-1-(5-amino-2-methylanilino)-1-oxopropan-2-yl]-butyl-methylazanium Traditional Name: [(1R)-2-(5-amino-2-methyl-anilino)-2-keto-1-methyl-ethyl]-butyl-methyl-ammonium Formula: C15H26N3O+ MolecularWeight: 264.38644

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)C(C)C(=O)NC1=C(C=CC(=C1)N)C

Isomeric SMILES

CCCC[NH+](C)[C@H](C)C(=O)NC1=C(C=CC(=C1)N)C

InChI

InChI=1S/C15H25N3O/c1-5-6-9-18(4)12(3)15(19)17-14-10-13(16)8-7-11(14)2/h7-8,10,12H,5-6,9,16H2,1-4H3,(H,17,19)/p+1/t12-/m1/s1