cycloheptyl-[(2S)-2-(4-dimethylaminophenyl)-2-oxidanyl-ethyl]azanium

Systemtic Name: cycloheptyl-[(2S)-2-(4-dimethylaminophenyl)-2-oxidanyl-ethyl]azanium Openeye Name: cycloheptyl-[(2S)-2-(4-dimethylaminophenyl)-2-hydroxy-ethyl]ammonium CAS Name: cycloheptyl-[(2S)-2-(4-dimethylaminophenyl)-2-hydroxyethyl]ammonium IUPAC Name: cycloheptyl-[(2S)-2-(4-dimethylaminophenyl)-2-hydroxyethyl]azanium Traditional Name: cycloheptyl-[(2S)-2-(4-dimethylaminophenyl)-2-hydroxy-ethyl]ammonium Formula: C17H29N2O+ MolecularWeight: 277.42496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(C[NH2+]C2CCCCCC2)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)[C@@H](C[NH2+]C2CCCCCC2)O

InChI

InChI=1S/C17H28N2O/c1-19(2)16-11-9-14(10-12-16)17(20)13-18-15-7-5-3-4-6-8-15/h9-12,15,17-18,20H,3-8,13H2,1-2H3/p+1/t17-/m1/s1