[(2R,3S)-3-methyl-4,4-diphenyl-butan-2-yl]-phenethyl-azanium

Systemtic Name: [(2R,3S)-3-methyl-4,4-diphenyl-butan-2-yl]-phenethyl-azanium Openeye Name: [(1R,2S)-1,2-dimethyl-3,3-diphenyl-propyl]-phenethyl-ammonium CAS Name: [(2R,3S)-3-methyl-4,4-diphenylbutan-2-yl]-phenethylammonium IUPAC Name: [(2R,3S)-3-methyl-4,4-diphenylbutan-2-yl]-phenethylazanium Traditional Name: [(1R,2S)-1,2-dimethyl-3,3-diphenyl-propyl]-phenethyl-ammonium Formula: C25H30N+ MolecularWeight: 344.5124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)[NH2+]CCC1=CC=CC=C1)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C[C@H]([C@@H](C)[NH2+]CCC1=CC=CC=C1)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H29N/c1-20(21(2)26-19-18-22-12-6-3-7-13-22)25(23-14-8-4-9-15-23)24-16-10-5-11-17-24/h3-17,20-21,25-26H,18-19H2,1-2H3/p+1/t20-,21-/m1/s1