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

Systemtic Name: 3-methyl-N-[2-(morpholin-4-ium-4-ylmethyl)-1-propyl-benzimidazol-5-yl]butanamide Openeye Name: 3-methyl-N-[2-(morpholin-4-ium-4-ylmethyl)-1-propyl-benzimidazol-5-yl]butanamide CAS Name: 3-methyl-N-[2-(4-morpholin-4-iumylmethyl)-1-propyl-5-benzimidazolyl]butanamide IUPAC Name: 3-methyl-N-[2-(morpholin-4-ium-4-ylmethyl)-1-propylbenzimidazol-5-yl]butanamide Traditional Name: 3-methyl-N-[2-(morpholin-4-ium-4-ylmethyl)-1-propyl-benzimidazol-5-yl]butyramide Formula: C20H31N4O2+ MolecularWeight: 359.48574

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)NC(=O)CC(C)C)N=C1C[NH+]3CCOCC3

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)NC(=O)CC(C)C)N=C1C[NH+]3CCOCC3

InChI

InChI=1S/C20H30N4O2/c1-4-7-24-18-6-5-16(21-20(25)12-15(2)3)13-17(18)22-19(24)14-23-8-10-26-11-9-23/h5-6,13,15H,4,7-12,14H2,1-3H3,(H,21,25)/p+1