N-[1-methyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]benzimidazol-5-yl]butanamide

Systemtic Name: N-[1-methyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]benzimidazol-5-yl]butanamide Openeye Name: N-[1-methyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]benzimidazol-5-yl]butanamide CAS Name: N-[1-methyl-2-[(4-methyl-1-piperidin-1-iumyl)methyl]-5-benzimidazolyl]butanamide IUPAC Name: N-[1-methyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]benzimidazol-5-yl]butanamide Traditional Name: N-[1-methyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]benzimidazol-5-yl]butyramide Formula: C19H29N4O+ MolecularWeight: 329.45976

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC2=C(C=C1)N(C(=N2)C[NH+]3CCC(CC3)C)C

Isomeric SMILES

CCCC(=O)NC1=CC2=C(C=C1)N(C(=N2)C[NH+]3CCC(CC3)C)C

InChI

InChI=1S/C19H28N4O/c1-4-5-19(24)20-15-6-7-17-16(12-15)21-18(22(17)3)13-23-10-8-14(2)9-11-23/h6-7,12,14H,4-5,8-11,13H2,1-3H3,(H,20,24)/p+1