4-[[4-(2-morpholin-4-ium-4-ylethoxy)phenyl]methylamino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[4-(2-morpholin-4-ium-4-ylethoxy)phenyl]methylamino]-4-oxidanylidene-butanoate Openeye Name: 4-[[4-(2-morpholin-4-ium-4-ylethoxy)phenyl]methylamino]-4-oxo-butanoate CAS Name: 4-[[4-[2-(4-morpholin-4-iumyl)ethoxy]phenyl]methylamino]-4-oxobutanoate IUPAC Name: 4-[[4-(2-morpholin-4-ium-4-ylethoxy)phenyl]methylamino]-4-oxobutanoate Traditional Name: 4-keto-4-[[4-(2-morpholin-4-ium-4-ylethoxy)benzyl]amino]butyrate Formula: C17H24N2O5 MolecularWeight: 336.38286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCOC2=CC=C(C=C2)CNC(=O)CCC(=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CCOC2=CC=C(C=C2)CNC(=O)CCC(=O)[O-]

InChI

InChI=1S/C17H24N2O5/c20-16(5-6-17(21)22)18-13-14-1-3-15(4-2-14)24-12-9-19-7-10-23-11-8-19/h1-4H,5-13H2,(H,18,20)(H,21,22)