[(3S)-3-(4-methoxyphenyl)-4-methyl-pentyl]-(phenylmethyl)azanium

Systemtic Name: [(3S)-3-(4-methoxyphenyl)-4-methyl-pentyl]-(phenylmethyl)azanium Openeye Name: benzyl-[(3S)-3-(4-methoxyphenyl)-4-methyl-pentyl]ammonium CAS Name: [(3S)-3-(4-methoxyphenyl)-4-methylpentyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-[(3S)-3-(4-methoxyphenyl)-4-methylpentyl]azanium Traditional Name: benzyl-[(3S)-3-(4-methoxyphenyl)-4-methyl-pentyl]ammonium Formula: C20H28NO+ MolecularWeight: 298.44242

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27NO/c1-16(2)20(18-9-11-19(22-3)12-10-18)13-14-21-15-17-7-5-4-6-8-17/h4-12,16,20-21H,13-15H2,1-3H3/p+1/t20-/m0/s1