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

Systemtic Name: N-[2-(morpholin-4-ium-4-ylmethyl)-1-propyl-benzimidazol-5-yl]butanamide Openeye Name: N-[2-(morpholin-4-ium-4-ylmethyl)-1-propyl-benzimidazol-5-yl]butanamide CAS Name: N-[2-(4-morpholin-4-iumylmethyl)-1-propyl-5-benzimidazolyl]butanamide IUPAC Name: N-[2-(morpholin-4-ium-4-ylmethyl)-1-propylbenzimidazol-5-yl]butanamide Traditional Name: N-[2-(morpholin-4-ium-4-ylmethyl)-1-propyl-benzimidazol-5-yl]butyramide Formula: C19H29N4O2+ MolecularWeight: 345.45916

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28N4O2/c1-3-5-19(24)20-15-6-7-17-16(13-15)21-18(23(17)8-4-2)14-22-9-11-25-12-10-22/h6-7,13H,3-5,8-12,14H2,1-2H3,(H,20,24)/p+1