4-[3-oxidanylidene-3-[2-(trimethylazaniumyl)ethylamino]propyl]phenolate

Systemtic Name: 4-[3-oxidanylidene-3-[2-(trimethylazaniumyl)ethylamino]propyl]phenolate Openeye Name: 4-[3-oxo-3-[2-(trimethylammonio)ethylamino]propyl]phenolate CAS Name: 4-[3-oxo-3-[2-(trimethylammonio)ethylamino]propyl]phenolate IUPAC Name: 4-[3-oxo-3-[2-(trimethylazaniumyl)ethylamino]propyl]phenolate Traditional Name: 4-[3-keto-3-[2-(trimethylammonio)ethylamino]propyl]phenolate Formula: C14H22N2O2 MolecularWeight: 250.33668

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCNC(=O)CCC1=CC=C(C=C1)[O-]

Isomeric SMILES

C[N+](C)(C)CCNC(=O)CCC1=CC=C(C=C1)[O-]

InChI

InChI=1S/C14H22N2O2/c1-16(2,3)11-10-15-14(18)9-6-12-4-7-13(17)8-5-12/h4-5,7-8H,6,9-11H2,1-3H3,(H-,15,17,18)