[3-[4-[(2S)-2-methylmorpholin-4-yl]butanoylamino]phenyl]methylazanium

Systemtic Name: [3-[4-[(2S)-2-methylmorpholin-4-yl]butanoylamino]phenyl]methylazanium Openeye Name: [3-[4-[(2S)-2-methylmorpholin-4-yl]butanoylamino]phenyl]methylammonium CAS Name: [3-[[4-[(2S)-2-methyl-4-morpholinyl]-1-oxobutyl]amino]phenyl]methylammonium IUPAC Name: [3-[4-[(2S)-2-methylmorpholin-4-yl]butanoylamino]phenyl]methylazanium Traditional Name: [3-[4-[(2S)-2-methylmorpholino]butanoylamino]benzyl]ammonium Formula: C16H26N3O2+ MolecularWeight: 292.39654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCO1)CCCC(=O)NC2=CC=CC(=C2)C[NH3+]

Isomeric SMILES

C[C@H]1CN(CCO1)CCCC(=O)NC2=CC=CC(=C2)C[NH3+]

InChI

InChI=1S/C16H25N3O2/c1-13-12-19(8-9-21-13)7-3-6-16(20)18-15-5-2-4-14(10-15)11-17/h2,4-5,10,13H,3,6-9,11-12,17H2,1H3,(H,18,20)/p+1/t13-/m0/s1