3-(3,5-dimethylphenoxy)propyl-methyl-[[4-(methylcarbamoyl)phenyl]methyl]azanium

Systemtic Name: 3-(3,5-dimethylphenoxy)propyl-methyl-[[4-(methylcarbamoyl)phenyl]methyl]azanium Openeye Name: 3-(3,5-dimethylphenoxy)propyl-methyl-[[4-(methylcarbamoyl)phenyl]methyl]ammonium CAS Name: 3-(3,5-dimethylphenoxy)propyl-methyl-[[4-(methylcarbamoyl)phenyl]methyl]ammonium IUPAC Name: 3-(3,5-dimethylphenoxy)propyl-methyl-[[4-(methylcarbamoyl)phenyl]methyl]azanium Traditional Name: 3-(3,5-dimethylphenoxy)propyl-methyl-[4-(methylcarbamoyl)benzyl]ammonium Formula: C21H29N2O2+ MolecularWeight: 341.46716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCC[NH+](C)CC2=CC=C(C=C2)C(=O)NC)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCC[NH+](C)CC2=CC=C(C=C2)C(=O)NC)C

InChI

InChI=1S/C21H28N2O2/c1-16-12-17(2)14-20(13-16)25-11-5-10-23(4)15-18-6-8-19(9-7-18)21(24)22-3/h6-9,12-14H,5,10-11,15H2,1-4H3,(H,22,24)/p+1