methyl-[(2S)-2-oxidanyl-2-phenyl-ethyl]-[2-(2,6,6-trimethylcyclohexen-1-yl)ethyl]azanium

Systemtic Name: methyl-[(2S)-2-oxidanyl-2-phenyl-ethyl]-[2-(2,6,6-trimethylcyclohexen-1-yl)ethyl]azanium Openeye Name: [(2S)-2-hydroxy-2-phenyl-ethyl]-methyl-[2-(2,6,6-trimethylcyclohexen-1-yl)ethyl]ammonium CAS Name: [(2S)-2-hydroxy-2-phenylethyl]-methyl-[2-(2,6,6-trimethyl-1-cyclohexenyl)ethyl]ammonium IUPAC Name: [(2S)-2-hydroxy-2-phenylethyl]-methyl-[2-(2,6,6-trimethylcyclohexen-1-yl)ethyl]azanium Traditional Name: [(2S)-2-hydroxy-2-phenyl-ethyl]-methyl-[2-(2,6,6-trimethylcyclohexen-1-yl)ethyl]ammonium Formula: C20H32NO+ MolecularWeight: 302.47418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1)(C)C)CC[NH+](C)CC(C2=CC=CC=C2)O

Isomeric SMILES

CC1=C(C(CCC1)(C)C)CC[NH+](C)C[C@H](C2=CC=CC=C2)O

InChI

InChI=1S/C20H31NO/c1-16-9-8-13-20(2,3)18(16)12-14-21(4)15-19(22)17-10-6-5-7-11-17/h5-7,10-11,19,22H,8-9,12-15H2,1-4H3/p+1/t19-/m1/s1