[(4S)-4-(2,6-dimethylphenoxy)-4-(2,5-dimethylphenyl)butyl]azanium

Systemtic Name: [(4S)-4-(2,6-dimethylphenoxy)-4-(2,5-dimethylphenyl)butyl]azanium Openeye Name: [(4S)-4-(2,6-dimethylphenoxy)-4-(2,5-dimethylphenyl)butyl]ammonium CAS Name: [(4S)-4-(2,6-dimethylphenoxy)-4-(2,5-dimethylphenyl)butyl]ammonium IUPAC Name: [(4S)-4-(2,6-dimethylphenoxy)-4-(2,5-dimethylphenyl)butyl]azanium Traditional Name: [(4S)-4-(2,6-dimethylphenoxy)-4-(2,5-dimethylphenyl)butyl]ammonium Formula: C20H28NO+ MolecularWeight: 298.44242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(CCC[NH3+])OC2=C(C=CC=C2C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)[C@H](CCC[NH3+])OC2=C(C=CC=C2C)C

InChI

InChI=1S/C20H27NO/c1-14-10-11-15(2)18(13-14)19(9-6-12-21)22-20-16(3)7-5-8-17(20)4/h5,7-8,10-11,13,19H,6,9,12,21H2,1-4H3/p+1/t19-/m0/s1