[(1S)-1-[5,6-dimethyl-1-[(4-propan-2-ylphenyl)methyl]benzimidazol-2-yl]propyl]azanium

Systemtic Name: [(1S)-1-[5,6-dimethyl-1-[(4-propan-2-ylphenyl)methyl]benzimidazol-2-yl]propyl]azanium Openeye Name: [(1S)-1-[1-[(4-isopropylphenyl)methyl]-5,6-dimethyl-benzimidazol-2-yl]propyl]ammonium CAS Name: [(1S)-1-[5,6-dimethyl-1-[(4-propan-2-ylphenyl)methyl]-2-benzimidazolyl]propyl]ammonium IUPAC Name: [(1S)-1-[5,6-dimethyl-1-[(4-propan-2-ylphenyl)methyl]benzimidazol-2-yl]propyl]azanium Traditional Name: [(1S)-1-[1-(4-isopropylbenzyl)-5,6-dimethyl-benzimidazol-2-yl]propyl]ammonium Formula: C22H30N3+ MolecularWeight: 336.4937

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=C(N1CC3=CC=C(C=C3)C(C)C)C=C(C(=C2)C)C)[NH3+]

Isomeric SMILES

CC[C@@H](C1=NC2=C(N1CC3=CC=C(C=C3)C(C)C)C=C(C(=C2)C)C)[NH3+]

InChI

InChI=1S/C22H29N3/c1-6-19(23)22-24-20-11-15(4)16(5)12-21(20)25(22)13-17-7-9-18(10-8-17)14(2)3/h7-12,14,19H,6,13,23H2,1-5H3/p+1/t19-/m0/s1