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

Systemtic Name: [(3S)-4-methyl-3-(4-propan-2-yloxyphenyl)pentyl]-[(4-propan-2-yloxyphenyl)methyl]azanium Openeye Name: (4-isopropoxyphenyl)methyl-[(3S)-3-(4-isopropoxyphenyl)-4-methyl-pentyl]ammonium CAS Name: [(3S)-4-methyl-3-(4-propan-2-yloxyphenyl)pentyl]-[(4-propan-2-yloxyphenyl)methyl]ammonium IUPAC Name: [(3S)-4-methyl-3-(4-propan-2-yloxyphenyl)pentyl]-[(4-propan-2-yloxyphenyl)methyl]azanium Traditional Name: (4-isopropoxybenzyl)-[(3S)-3-(4-isopropoxyphenyl)-4-methyl-pentyl]ammonium Formula: C25H38NO2+ MolecularWeight: 384.57472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC[NH2+]CC1=CC=C(C=C1)OC(C)C)C2=CC=C(C=C2)OC(C)C

Isomeric SMILES

CC(C)[C@H](CC[NH2+]CC1=CC=C(C=C1)OC(C)C)C2=CC=C(C=C2)OC(C)C

InChI

InChI=1S/C25H37NO2/c1-18(2)25(22-9-13-24(14-10-22)28-20(5)6)15-16-26-17-21-7-11-23(12-8-21)27-19(3)4/h7-14,18-20,25-26H,15-17H2,1-6H3/p+1/t25-/m0/s1