dimethyl-[(1S)-2-[4-(2-methylphenoxy)butanoylamino]-1-phenyl-ethyl]azanium

Systemtic Name: dimethyl-[(1S)-2-[4-(2-methylphenoxy)butanoylamino]-1-phenyl-ethyl]azanium Openeye Name: dimethyl-[(1S)-2-[4-(2-methylphenoxy)butanoylamino]-1-phenyl-ethyl]ammonium CAS Name: dimethyl-[(1S)-2-[[4-(2-methylphenoxy)-1-oxobutyl]amino]-1-phenylethyl]ammonium IUPAC Name: dimethyl-[(1S)-2-[4-(2-methylphenoxy)butanoylamino]-1-phenylethyl]azanium Traditional Name: dimethyl-[(1S)-2-[4-(2-methylphenoxy)butanoylamino]-1-phenyl-ethyl]ammonium Formula: C21H29N2O2+ MolecularWeight: 341.46716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCCC(=O)NCC(C2=CC=CC=C2)[NH+](C)C

Isomeric SMILES

CC1=CC=CC=C1OCCCC(=O)NC[C@H](C2=CC=CC=C2)[NH+](C)C

InChI

InChI=1S/C21H28N2O2/c1-17-10-7-8-13-20(17)25-15-9-14-21(24)22-16-19(23(2)3)18-11-5-4-6-12-18/h4-8,10-13,19H,9,14-16H2,1-3H3,(H,22,24)/p+1/t19-/m1/s1