4-[[1-(3-methylbutyl)benzimidazol-2-yl]methyl]morpholin-4-ium

Systemtic Name: 4-[[1-(3-methylbutyl)benzimidazol-2-yl]methyl]morpholin-4-ium Openeye Name: 4-[(1-isopentylbenzimidazol-2-yl)methyl]morpholin-4-ium CAS Name: 4-[[1-(3-methylbutyl)-2-benzimidazolyl]methyl]morpholin-4-ium IUPAC Name: 4-[[1-(3-methylbutyl)benzimidazol-2-yl]methyl]morpholin-4-ium Traditional Name: 4-[(1-isoamylbenzimidazol-2-yl)methyl]morpholin-4-ium Formula: C17H26N3O+ MolecularWeight: 288.40784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=CC=CC=C2N=C1C[NH+]3CCOCC3

Isomeric SMILES

CC(C)CCN1C2=CC=CC=C2N=C1C[NH+]3CCOCC3

InChI

InChI=1S/C17H25N3O/c1-14(2)7-8-20-16-6-4-3-5-15(16)18-17(20)13-19-9-11-21-12-10-19/h3-6,14H,7-13H2,1-2H3/p+1