4-[[2-[2-(diethylazaniumyl)ethoxy]naphthalen-1-yl]methylamino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[2-[2-(diethylazaniumyl)ethoxy]naphthalen-1-yl]methylamino]-4-oxidanylidene-butanoate Openeye Name: 4-[[2-[2-(diethylammonio)ethoxy]-1-naphthyl]methylamino]-4-oxo-butanoate CAS Name: 4-[[2-[2-(diethylammonio)ethoxy]-1-naphthalenyl]methylamino]-4-oxobutanoate IUPAC Name: 4-[[2-[2-(diethylazaniumyl)ethoxy]naphthalen-1-yl]methylamino]-4-oxobutanoate Traditional Name: 4-[[2-[2-(diethylammonio)ethoxy]-1-naphthyl]methylamino]-4-keto-butyrate Formula: C21H28N2O4 MolecularWeight: 372.45802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCOC1=C(C2=CC=CC=C2C=C1)CNC(=O)CCC(=O)[O-]

Isomeric SMILES

CC[NH+](CC)CCOC1=C(C2=CC=CC=C2C=C1)CNC(=O)CCC(=O)[O-]

InChI

InChI=1S/C21H28N2O4/c1-3-23(4-2)13-14-27-19-10-9-16-7-5-6-8-17(16)18(19)15-22-20(24)11-12-21(25)26/h5-10H,3-4,11-15H2,1-2H3,(H,22,24)(H,25,26)