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

Systemtic Name: 2-methoxy-4-[3-oxidanylidene-3-[2-(trimethylazaniumyl)ethylamino]propyl]phenolate Openeye Name: 2-methoxy-4-[3-oxo-3-[2-(trimethylammonio)ethylamino]propyl]phenolate CAS Name: 2-methoxy-4-[3-oxo-3-[2-(trimethylammonio)ethylamino]propyl]phenolate IUPAC Name: 2-methoxy-4-[3-oxo-3-[2-(trimethylazaniumyl)ethylamino]propyl]phenolate Traditional Name: 4-[3-keto-3-[2-(trimethylammonio)ethylamino]propyl]-2-methoxy-phenolate Formula: C15H24N2O3 MolecularWeight: 280.36266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H24N2O3/c1-17(2,3)10-9-16-15(19)8-6-12-5-7-13(18)14(11-12)20-4/h5,7,11H,6,8-10H2,1-4H3,(H-,16,18,19)