5-[1-[(4-propan-2-ylphenyl)methyl]benzimidazol-2-yl]pentylazanium

Systemtic Name: 5-[1-[(4-propan-2-ylphenyl)methyl]benzimidazol-2-yl]pentylazanium Openeye Name: 5-[1-[(4-isopropylphenyl)methyl]benzimidazol-2-yl]pentylammonium CAS Name: 5-[1-[(4-propan-2-ylphenyl)methyl]-2-benzimidazolyl]pentylammonium IUPAC Name: 5-[1-[(4-propan-2-ylphenyl)methyl]benzimidazol-2-yl]pentylazanium Traditional Name: 5-[1-(4-isopropylbenzyl)benzimidazol-2-yl]pentylammonium Formula: C22H30N3+ MolecularWeight: 336.4937

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2CCCCC[NH3+]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2CCCCC[NH3+]

InChI

InChI=1S/C22H29N3/c1-17(2)19-13-11-18(12-14-19)16-25-21-9-6-5-8-20(21)24-22(25)10-4-3-7-15-23/h5-6,8-9,11-14,17H,3-4,7,10,15-16,23H2,1-2H3/p+1