3-phenylpropyl-[(1S)-1-(2,4,5-trimethylphenyl)ethyl]azanium

Systemtic Name: 3-phenylpropyl-[(1S)-1-(2,4,5-trimethylphenyl)ethyl]azanium Openeye Name: 3-phenylpropyl-[(1S)-1-(2,4,5-trimethylphenyl)ethyl]ammonium CAS Name: 3-phenylpropyl-[(1S)-1-(2,4,5-trimethylphenyl)ethyl]ammonium IUPAC Name: 3-phenylpropyl-[(1S)-1-(2,4,5-trimethylphenyl)ethyl]azanium Traditional Name: 3-phenylpropyl-[(1S)-1-(2,4,5-trimethylphenyl)ethyl]ammonium Formula: C20H28N+ MolecularWeight: 282.44302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)C(C)[NH2+]CCCC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=C(C=C1C)[C@H](C)[NH2+]CCCC2=CC=CC=C2)C

InChI

InChI=1S/C20H27N/c1-15-13-17(3)20(14-16(15)2)18(4)21-12-8-11-19-9-6-5-7-10-19/h5-7,9-10,13-14,18,21H,8,11-12H2,1-4H3/p+1/t18-/m0/s1