(2-methoxy-2-oxidanylidene-ethyl)-(3-phenylpropyl)azanium

Systemtic Name: (2-methoxy-2-oxidanylidene-ethyl)-(3-phenylpropyl)azanium Openeye Name: (2-methoxy-2-oxo-ethyl)-(3-phenylpropyl)ammonium CAS Name: (2-methoxy-2-oxoethyl)-(3-phenylpropyl)ammonium IUPAC Name: (2-methoxy-2-oxoethyl)-(3-phenylpropyl)azanium Traditional Name: (2-keto-2-methoxy-ethyl)-(3-phenylpropyl)ammonium Formula: C12H18NO2+ MolecularWeight: 208.27682

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C[NH2+]CCCC1=CC=CC=C1

Isomeric SMILES

COC(=O)C[NH2+]CCCC1=CC=CC=C1

InChI

InChI=1S/C12H17NO2/c1-15-12(14)10-13-9-5-8-11-6-3-2-4-7-11/h2-4,6-7,13H,5,8-10H2,1H3/p+1