diethyl-[(1S)-1-phenyl-2-[2-(4-propanoylphenoxy)ethanoylamino]ethyl]azanium

Systemtic Name: diethyl-[(1S)-1-phenyl-2-[2-(4-propanoylphenoxy)ethanoylamino]ethyl]azanium Openeye Name: diethyl-[(1S)-1-phenyl-2-[[2-(4-propanoylphenoxy)acetyl]amino]ethyl]ammonium CAS Name: diethyl-[(1S)-2-[[1-oxo-2-[4-(1-oxopropyl)phenoxy]ethyl]amino]-1-phenylethyl]ammonium IUPAC Name: diethyl-[(1S)-1-phenyl-2-[[2-(4-propanoylphenoxy)acetyl]amino]ethyl]azanium Traditional Name: diethyl-[(1S)-1-phenyl-2-[[2-(4-propionylphenoxy)acetyl]amino]ethyl]ammonium Formula: C23H31N2O3+ MolecularWeight: 383.50384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC(=O)NCC(C2=CC=CC=C2)[NH+](CC)CC

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCC(=O)NC[C@H](C2=CC=CC=C2)[NH+](CC)CC

InChI

InChI=1S/C23H30N2O3/c1-4-22(26)19-12-14-20(15-13-19)28-17-23(27)24-16-21(25(5-2)6-3)18-10-8-7-9-11-18/h7-15,21H,4-6,16-17H2,1-3H3,(H,24,27)/p+1/t21-/m1/s1