N-[2-(morpholin-4-ium-4-ylmethyl)-1-propyl-benzimidazol-5-yl]pentanamide

Systemtic Name: N-[2-(morpholin-4-ium-4-ylmethyl)-1-propyl-benzimidazol-5-yl]pentanamide Openeye Name: N-[2-(morpholin-4-ium-4-ylmethyl)-1-propyl-benzimidazol-5-yl]pentanamide CAS Name: N-[2-(4-morpholin-4-iumylmethyl)-1-propyl-5-benzimidazolyl]pentanamide IUPAC Name: N-[2-(morpholin-4-ium-4-ylmethyl)-1-propylbenzimidazol-5-yl]pentanamide Traditional Name: N-[2-(morpholin-4-ium-4-ylmethyl)-1-propyl-benzimidazol-5-yl]valeramide Formula: C20H31N4O2+ MolecularWeight: 359.48574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC2=C(C=C1)N(C(=N2)C[NH+]3CCOCC3)CCC

Isomeric SMILES

CCCCC(=O)NC1=CC2=C(C=C1)N(C(=N2)C[NH+]3CCOCC3)CCC

InChI

InChI=1S/C20H30N4O2/c1-3-5-6-20(25)21-16-7-8-18-17(14-16)22-19(24(18)9-4-2)15-23-10-12-26-13-11-23/h7-8,14H,3-6,9-13,15H2,1-2H3,(H,21,25)/p+1