diethyl-[(2S)-1-[[3-(methoxymethyl)phenyl]carbonylamino]-3-phenyl-propan-2-yl]azanium

Systemtic Name: diethyl-[(2S)-1-[[3-(methoxymethyl)phenyl]carbonylamino]-3-phenyl-propan-2-yl]azanium Openeye Name: [(1S)-1-benzyl-2-[[3-(methoxymethyl)benzoyl]amino]ethyl]-diethyl-ammonium CAS Name: diethyl-[(2S)-1-[[[3-(methoxymethyl)phenyl]-oxomethyl]amino]-3-phenylpropan-2-yl]ammonium IUPAC Name: diethyl-[(2S)-1-[[3-(methoxymethyl)benzoyl]amino]-3-phenylpropan-2-yl]azanium Traditional Name: [(1S)-1-benzyl-2-[[3-(methoxymethyl)benzoyl]amino]ethyl]-diethyl-ammonium Formula: C22H31N2O2+ MolecularWeight: 355.49374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CC1=CC=CC=C1)CNC(=O)C2=CC(=CC=C2)COC

Isomeric SMILES

CC[NH+](CC)[C@@H](CC1=CC=CC=C1)CNC(=O)C2=CC(=CC=C2)COC

InChI

InChI=1S/C22H30N2O2/c1-4-24(5-2)21(15-18-10-7-6-8-11-18)16-23-22(25)20-13-9-12-19(14-20)17-26-3/h6-14,21H,4-5,15-17H2,1-3H3,(H,23,25)/p+1/t21-/m0/s1