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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CCC[NH3+])OC2=C(C=CC=C2C)C

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](CCC[NH3+])OC2=C(C=CC=C2C)C

InChI

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