[(1S,2S,4R)-4-tert-butyl-2-(3-ethylphenoxy)cyclohexyl]azanium

Systemtic Name: [(1S,2S,4R)-4-tert-butyl-2-(3-ethylphenoxy)cyclohexyl]azanium Openeye Name: [(1S,2S,4R)-4-tert-butyl-2-(3-ethylphenoxy)cyclohexyl]ammonium CAS Name: [(1S,2S,4R)-4-tert-butyl-2-(3-ethylphenoxy)cyclohexyl]ammonium IUPAC Name: [(1S,2S,4R)-4-tert-butyl-2-(3-ethylphenoxy)cyclohexyl]azanium Traditional Name: [(1S,2S,4R)-4-tert-butyl-2-(3-ethylphenoxy)cyclohexyl]ammonium Formula: C18H30NO+ MolecularWeight: 276.4369

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)OC2CC(CCC2[NH3+])C(C)(C)C

Isomeric SMILES

CCC1=CC(=CC=C1)O[C@H]2C[C@@H](CC[C@@H]2[NH3+])C(C)(C)C

InChI

InChI=1S/C18H29NO/c1-5-13-7-6-8-15(11-13)20-17-12-14(18(2,3)4)9-10-16(17)19/h6-8,11,14,16-17H,5,9-10,12,19H2,1-4H3/p+1/t14-,16+,17+/m1/s1