diethyl-[3-[[(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]amino]propyl]azanium

Systemtic Name: diethyl-[3-[[(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]amino]propyl]azanium Openeye Name: 3-[[(1R)-2-anilino-1-methyl-2-oxo-ethyl]amino]propyl-diethyl-ammonium CAS Name: 3-[[(2R)-1-anilino-1-oxopropan-2-yl]amino]propyl-diethylammonium IUPAC Name: 3-[[(2R)-1-anilino-1-oxopropan-2-yl]amino]propyl-diethylazanium Traditional Name: 3-[[(1R)-2-anilino-2-keto-1-methyl-ethyl]amino]propyl-diethyl-ammonium Formula: C16H28N3O+ MolecularWeight: 278.41302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H27N3O/c1-4-19(5-2)13-9-12-17-14(3)16(20)18-15-10-7-6-8-11-15/h6-8,10-11,14,17H,4-5,9,12-13H2,1-3H3,(H,18,20)/p+1/t14-/m1/s1