[4-[(1S,2R,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxyphenyl]methylazanium

Systemtic Name: [4-[(1S,2R,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxyphenyl]methylazanium Openeye Name: [4-[(1S,2R,5R)-2-isopropyl-5-methyl-cyclohexoxy]phenyl]methylammonium CAS Name: [4-[(1S,2R,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxyphenyl]methylammonium IUPAC Name: [4-[(1S,2R,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxyphenyl]methylazanium Traditional Name: [4-[(1S,2R,5R)-2-isopropyl-5-methyl-cyclohexoxy]benzyl]ammonium Formula: C17H28NO+ MolecularWeight: 262.41032

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC2=CC=C(C=C2)C[NH3+])C(C)C

Isomeric SMILES

C[C@@H]1CC[C@@H]([C@H](C1)OC2=CC=C(C=C2)C[NH3+])C(C)C

InChI

InChI=1S/C17H27NO/c1-12(2)16-9-4-13(3)10-17(16)19-15-7-5-14(11-18)6-8-15/h5-8,12-13,16-17H,4,9-11,18H2,1-3H3/p+1/t13-,16-,17+/m1/s1