[(2R)-6-methyl-6-oxidanyl-heptan-2-yl]-(1-phenethylpiperidin-4-yl)azanium

Systemtic Name: [(2R)-6-methyl-6-oxidanyl-heptan-2-yl]-(1-phenethylpiperidin-4-yl)azanium Openeye Name: [(1R)-5-hydroxy-1,5-dimethyl-hexyl]-(1-phenethyl-4-piperidyl)ammonium CAS Name: [(2R)-6-hydroxy-6-methylheptan-2-yl]-(1-phenethyl-4-piperidinyl)ammonium IUPAC Name: [(2R)-6-hydroxy-6-methylheptan-2-yl]-(1-phenethylpiperidin-4-yl)azanium Traditional Name: [(1R)-5-hydroxy-1,5-dimethyl-hexyl]-(1-phenethyl-4-piperidyl)ammonium Formula: C21H37N2O+ MolecularWeight: 333.53128

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(C)(C)O)[NH2+]C1CCN(CC1)CCC2=CC=CC=C2

Isomeric SMILES

C[C@H](CCCC(C)(C)O)[NH2+]C1CCN(CC1)CCC2=CC=CC=C2

InChI

InChI=1S/C21H36N2O/c1-18(8-7-14-21(2,3)24)22-20-12-16-23(17-13-20)15-11-19-9-5-4-6-10-19/h4-6,9-10,18,20,22,24H,7-8,11-17H2,1-3H3/p+1/t18-/m1/s1