3-(4-aminocarbonylphenyl)propyl-ethyl-[2-(4-hydroxyphenyl)-2-oxidanyl-ethyl]-methyl-azanium

Systemtic Name: 3-(4-aminocarbonylphenyl)propyl-ethyl-[2-(4-hydroxyphenyl)-2-oxidanyl-ethyl]-methyl-azanium Openeye Name: 3-(4-carbamoylphenyl)propyl-ethyl-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]-methyl-ammonium CAS Name: 3-(4-carbamoylphenyl)propyl-ethyl-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]-methylammonium IUPAC Name: 3-(4-carbamoylphenyl)propyl-ethyl-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]-methylazanium Traditional Name: 3-(4-carbamoylphenyl)propyl-ethyl-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]-methyl-ammonium Formula: C21H29N2O3+ MolecularWeight: 357.46656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CCCC1=CC=C(C=C1)C(=O)N)CC(C2=CC=C(C=C2)O)O

Isomeric SMILES

CC[N+](C)(CCCC1=CC=C(C=C1)C(=O)N)CC(C2=CC=C(C=C2)O)O

InChI

InChI=1S/C21H28N2O3/c1-3-23(2,15-20(25)17-10-12-19(24)13-11-17)14-4-5-16-6-8-18(9-7-16)21(22)26/h6-13,20,25H,3-5,14-15H2,1-2H3,(H2-,22,24,26)/p+1