[1-(2-methylpropanoyl)-4-oxidanyl-piperidin-4-yl]methyl-phenethyl-azanium

Systemtic Name: [1-(2-methylpropanoyl)-4-oxidanyl-piperidin-4-yl]methyl-phenethyl-azanium Openeye Name: [4-hydroxy-1-(2-methylpropanoyl)-4-piperidyl]methyl-phenethyl-ammonium CAS Name: [4-hydroxy-1-(2-methyl-1-oxopropyl)-4-piperidinyl]methyl-phenethylammonium IUPAC Name: [4-hydroxy-1-(2-methylpropanoyl)piperidin-4-yl]methyl-phenethylazanium Traditional Name: (4-hydroxy-1-isobutyryl-4-piperidyl)methyl-phenethyl-ammonium Formula: C18H29N2O2+ MolecularWeight: 305.43506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCC(CC1)(C[NH2+]CCC2=CC=CC=C2)O

Isomeric SMILES

CC(C)C(=O)N1CCC(CC1)(C[NH2+]CCC2=CC=CC=C2)O

InChI

InChI=1S/C18H28N2O2/c1-15(2)17(21)20-12-9-18(22,10-13-20)14-19-11-8-16-6-4-3-5-7-16/h3-7,15,19,22H,8-14H2,1-2H3/p+1