(3-methoxy-4-propan-2-yloxy-phenyl)methyl-[(1S,2R)-2-methylcyclohexyl]azanium

Systemtic Name: (3-methoxy-4-propan-2-yloxy-phenyl)methyl-[(1S,2R)-2-methylcyclohexyl]azanium Openeye Name: (4-isopropoxy-3-methoxy-phenyl)methyl-[(1S,2R)-2-methylcyclohexyl]ammonium CAS Name: (3-methoxy-4-propan-2-yloxyphenyl)methyl-[(1S,2R)-2-methylcyclohexyl]ammonium IUPAC Name: (3-methoxy-4-propan-2-yloxyphenyl)methyl-[(1S,2R)-2-methylcyclohexyl]azanium Traditional Name: (4-isopropoxy-3-methoxy-benzyl)-[(1S,2R)-2-methylcyclohexyl]ammonium Formula: C18H30NO2+ MolecularWeight: 292.4363

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1[NH2+]CC2=CC(=C(C=C2)OC(C)C)OC

Isomeric SMILES

C[C@@H]1CCCC[C@@H]1[NH2+]CC2=CC(=C(C=C2)OC(C)C)OC

InChI

InChI=1S/C18H29NO2/c1-13(2)21-17-10-9-15(11-18(17)20-4)12-19-16-8-6-5-7-14(16)3/h9-11,13-14,16,19H,5-8,12H2,1-4H3/p+1/t14-,16+/m1/s1