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

Systemtic Name: [(3S)-4-methyl-3-(4-propan-2-yloxyphenyl)pentyl]-(phenylmethyl)azanium Openeye Name: benzyl-[(3S)-3-(4-isopropoxyphenyl)-4-methyl-pentyl]ammonium CAS Name: [(3S)-4-methyl-3-(4-propan-2-yloxyphenyl)pentyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-[(3S)-4-methyl-3-(4-propan-2-yloxyphenyl)pentyl]azanium Traditional Name: benzyl-[(3S)-3-(4-isopropoxyphenyl)-4-methyl-pentyl]ammonium Formula: C22H32NO+ MolecularWeight: 326.49558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H31NO/c1-17(2)22(14-15-23-16-19-8-6-5-7-9-19)20-10-12-21(13-11-20)24-18(3)4/h5-13,17-18,22-23H,14-16H2,1-4H3/p+1/t22-/m0/s1