[(3S)-3-(3-tert-butylphenoxy)-3-(3,4-dimethylphenyl)propyl]azanium

Systemtic Name: [(3S)-3-(3-tert-butylphenoxy)-3-(3,4-dimethylphenyl)propyl]azanium Openeye Name: [(3S)-3-(3-tert-butylphenoxy)-3-(3,4-dimethylphenyl)propyl]ammonium CAS Name: [(3S)-3-(3-tert-butylphenoxy)-3-(3,4-dimethylphenyl)propyl]ammonium IUPAC Name: [(3S)-3-(3-tert-butylphenoxy)-3-(3,4-dimethylphenyl)propyl]azanium Traditional Name: [(3S)-3-(3-tert-butylphenoxy)-3-(3,4-dimethylphenyl)propyl]ammonium Formula: C21H30NO+ MolecularWeight: 312.469

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(CC[NH3+])OC2=CC=CC(=C2)C(C)(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)[C@H](CC[NH3+])OC2=CC=CC(=C2)C(C)(C)C)C

InChI

InChI=1S/C21H29NO/c1-15-9-10-17(13-16(15)2)20(11-12-22)23-19-8-6-7-18(14-19)21(3,4)5/h6-10,13-14,20H,11-12,22H2,1-5H3/p+1/t20-/m0/s1