[(3R)-3-cyclohexyl-3-(4-propan-2-yloxyphenyl)propyl]-[(3,4-dimethoxyphenyl)methyl]azanium

Systemtic Name: [(3R)-3-cyclohexyl-3-(4-propan-2-yloxyphenyl)propyl]-[(3,4-dimethoxyphenyl)methyl]azanium Openeye Name: [(3R)-3-cyclohexyl-3-(4-isopropoxyphenyl)propyl]-[(3,4-dimethoxyphenyl)methyl]ammonium CAS Name: [(3R)-3-cyclohexyl-3-(4-propan-2-yloxyphenyl)propyl]-[(3,4-dimethoxyphenyl)methyl]ammonium IUPAC Name: [(3R)-3-cyclohexyl-3-(4-propan-2-yloxyphenyl)propyl]-[(3,4-dimethoxyphenyl)methyl]azanium Traditional Name: [(3R)-3-cyclohexyl-3-(4-isopropoxyphenyl)propyl]-veratryl-ammonium Formula: C27H40NO3+ MolecularWeight: 426.6114

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(CC[NH2+]CC2=CC(=C(C=C2)OC)OC)C3CCCCC3

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)[C@H](CC[NH2+]CC2=CC(=C(C=C2)OC)OC)C3CCCCC3

InChI

InChI=1S/C27H39NO3/c1-20(2)31-24-13-11-23(12-14-24)25(22-8-6-5-7-9-22)16-17-28-19-21-10-15-26(29-3)27(18-21)30-4/h10-15,18,20,22,25,28H,5-9,16-17,19H2,1-4H3/p+1/t25-/m1/s1