4-[2-[4-[2-(diethylazaniumyl)ethoxy]phenyl]ethylamino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[2-[4-[2-(diethylazaniumyl)ethoxy]phenyl]ethylamino]-4-oxidanylidene-butanoate Openeye Name: 4-[2-[4-[2-(diethylammonio)ethoxy]phenyl]ethylamino]-4-oxo-butanoate CAS Name: 4-[2-[4-[2-(diethylammonio)ethoxy]phenyl]ethylamino]-4-oxobutanoate IUPAC Name: 4-[2-[4-[2-(diethylazaniumyl)ethoxy]phenyl]ethylamino]-4-oxobutanoate Traditional Name: 4-[2-[4-[2-(diethylammonio)ethoxy]phenyl]ethylamino]-4-keto-butyrate Formula: C18H28N2O4 MolecularWeight: 336.42592

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCOC1=CC=C(C=C1)CCNC(=O)CCC(=O)[O-]

Isomeric SMILES

CC[NH+](CC)CCOC1=CC=C(C=C1)CCNC(=O)CCC(=O)[O-]

InChI

InChI=1S/C18H28N2O4/c1-3-20(4-2)13-14-24-16-7-5-15(6-8-16)11-12-19-17(21)9-10-18(22)23/h5-8H,3-4,9-14H2,1-2H3,(H,19,21)(H,22,23)