[(2R)-3-(4-tert-butylcyclohexyl)oxy-2-oxidanyl-propyl]-[(1R)-1-phenylethyl]azanium

Systemtic Name: [(2R)-3-(4-tert-butylcyclohexyl)oxy-2-oxidanyl-propyl]-[(1R)-1-phenylethyl]azanium Openeye Name: [(2R)-3-(4-tert-butylcyclohexoxy)-2-hydroxy-propyl]-[(1R)-1-phenylethyl]ammonium CAS Name: [(2R)-3-(4-tert-butylcyclohexyl)oxy-2-hydroxypropyl]-[(1R)-1-phenylethyl]ammonium IUPAC Name: [(2R)-3-(4-tert-butylcyclohexyl)oxy-2-hydroxypropyl]-[(1R)-1-phenylethyl]azanium Traditional Name: [(2R)-3-(4-tert-butylcyclohexoxy)-2-hydroxy-propyl]-[(1R)-1-phenylethyl]ammonium Formula: C21H36NO2+ MolecularWeight: 334.51604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[NH2+]CC(COC2CCC(CC2)C(C)(C)C)O

Isomeric SMILES

C[C@H](C1=CC=CC=C1)[NH2+]C[C@H](COC2CCC(CC2)C(C)(C)C)O

InChI

InChI=1S/C21H35NO2/c1-16(17-8-6-5-7-9-17)22-14-19(23)15-24-20-12-10-18(11-13-20)21(2,3)4/h5-9,16,18-20,22-23H,10-15H2,1-4H3/p+1/t16-,18?,19-,20?/m1/s1