[(4S)-4-(3-methylphenoxy)-4-(4-propan-2-ylphenyl)butyl]azanium

Systemtic Name: [(4S)-4-(3-methylphenoxy)-4-(4-propan-2-ylphenyl)butyl]azanium Openeye Name: [(4S)-4-(4-isopropylphenyl)-4-(3-methylphenoxy)butyl]ammonium CAS Name: [(4S)-4-(3-methylphenoxy)-4-(4-propan-2-ylphenyl)butyl]ammonium IUPAC Name: [(4S)-4-(3-methylphenoxy)-4-(4-propan-2-ylphenyl)butyl]azanium Traditional Name: [(4S)-4-(3-methylphenoxy)-4-p-cumenyl-butyl]ammonium Formula: C20H28NO+ MolecularWeight: 298.44242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC(CCC[NH3+])C2=CC=C(C=C2)C(C)C

Isomeric SMILES

CC1=CC(=CC=C1)O[C@@H](CCC[NH3+])C2=CC=C(C=C2)C(C)C

InChI

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