[2-[methyl-(2-oxidaniumyl-2-oxidanylidene-ethyl)amino]-1-phenyl-propyl]oxidanium

Systemtic Name: [2-[methyl-(2-oxidaniumyl-2-oxidanylidene-ethyl)amino]-1-phenyl-propyl]oxidanium Openeye Name: [2-[methyl-(1-methyl-2-oxonio-2-phenyl-ethyl)amino]acetyl]oxonium CAS Name: [2-[methyl-(1-oxonio-1-phenylpropan-2-yl)amino]-1-oxoethyl]oxonium IUPAC Name: [2-[methyl-(1-oxonio-1-phenylpropan-2-yl)amino]acetyl]oxidanium Traditional Name: [2-[(2-keto-2-oxonio-ethyl)-methyl-amino]-1-phenyl-propyl]oxonium Formula: C12H19NO3+2 MolecularWeight: 225.28416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)[OH2+])N(C)CC(=O)[OH2+]

Isomeric SMILES

CC(C(C1=CC=CC=C1)[OH2+])N(C)CC(=O)[OH2+]

InChI

InChI=1S/C12H17NO3/c1-9(13(2)8-11(14)15)12(16)10-6-4-3-5-7-10/h3-7,9,12,16H,8H2,1-2H3,(H,14,15)/p+2