(4-methoxyphenyl)methyl-[(3S)-3-(2-methoxyphenyl)-3-(4-propan-2-yloxyphenyl)propyl]azanium

Systemtic Name: (4-methoxyphenyl)methyl-[(3S)-3-(2-methoxyphenyl)-3-(4-propan-2-yloxyphenyl)propyl]azanium Openeye Name: [(3S)-3-(4-isopropoxyphenyl)-3-(2-methoxyphenyl)propyl]-[(4-methoxyphenyl)methyl]ammonium CAS Name: (4-methoxyphenyl)methyl-[(3S)-3-(2-methoxyphenyl)-3-(4-propan-2-yloxyphenyl)propyl]ammonium IUPAC Name: (4-methoxyphenyl)methyl-[(3S)-3-(2-methoxyphenyl)-3-(4-propan-2-yloxyphenyl)propyl]azanium Traditional Name: [(3S)-3-(4-isopropoxyphenyl)-3-(2-methoxyphenyl)propyl]-p-anisyl-ammonium Formula: C27H34NO3+ MolecularWeight: 420.56376

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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)C3=CC=CC=C3OC

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)[C@H](CC[NH2+]CC2=CC=C(C=C2)OC)C3=CC=CC=C3OC

InChI

InChI=1S/C27H33NO3/c1-20(2)31-24-15-11-22(12-16-24)25(26-7-5-6-8-27(26)30-4)17-18-28-19-21-9-13-23(29-3)14-10-21/h5-16,20,25,28H,17-19H2,1-4H3/p+1/t25-/m0/s1