[(1S)-1-[5,6-dimethyl-1-(3-phenylpropyl)benzimidazol-2-yl]propyl]azanium

Systemtic Name: [(1S)-1-[5,6-dimethyl-1-(3-phenylpropyl)benzimidazol-2-yl]propyl]azanium Openeye Name: [(1S)-1-[5,6-dimethyl-1-(3-phenylpropyl)benzimidazol-2-yl]propyl]ammonium CAS Name: [(1S)-1-[5,6-dimethyl-1-(3-phenylpropyl)-2-benzimidazolyl]propyl]ammonium IUPAC Name: [(1S)-1-[5,6-dimethyl-1-(3-phenylpropyl)benzimidazol-2-yl]propyl]azanium Traditional Name: [(1S)-1-[5,6-dimethyl-1-(3-phenylpropyl)benzimidazol-2-yl]propyl]ammonium Formula: C21H28N3+ MolecularWeight: 322.46712

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=C(N1CCCC3=CC=CC=C3)C=C(C(=C2)C)C)[NH3+]

Isomeric SMILES

CC[C@@H](C1=NC2=C(N1CCCC3=CC=CC=C3)C=C(C(=C2)C)C)[NH3+]

InChI

InChI=1S/C21H27N3/c1-4-18(22)21-23-19-13-15(2)16(3)14-20(19)24(21)12-8-11-17-9-6-5-7-10-17/h5-7,9-10,13-14,18H,4,8,11-12,22H2,1-3H3/p+1/t18-/m0/s1