4-[[1-(2-ethanimidoylpiperidin-4-yl)oxy-2-propan-2-yl-benzimidazol-1-ium-1-yl]methyl]naphthalene-1-carboximidamide

Systemtic Name: 4-[[1-(2-ethanimidoylpiperidin-4-yl)oxy-2-propan-2-yl-benzimidazol-1-ium-1-yl]methyl]naphthalene-1-carboximidamide Openeye Name: 4-[[1-[(2-ethanimidoyl-4-piperidyl)oxy]-2-isopropyl-benzimidazol-1-ium-1-yl]methyl]naphthalene-1-carboxamidine CAS Name: 4-[[1-[[2-(1-iminoethyl)-4-piperidinyl]oxy]-2-propan-2-yl-1-benzimidazol-1-iumyl]methyl]-1-naphthalenecarboximidamide IUPAC Name: 4-[[1-(2-ethanimidoylpiperidin-4-yl)oxy-2-propan-2-ylbenzimidazol-1-ium-1-yl]methyl]naphthalene-1-carboximidamide Traditional Name: 4-[[1-[(2-acetimidoyl-4-piperidyl)oxy]-2-isopropyl-benzimidazol-1-ium-1-yl]methyl]-1-naphthamidine Formula: C29H35N6O+ MolecularWeight: 483.6278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2[N+]1(CC3=CC=C(C4=CC=CC=C34)C(=N)N)OC5CCNC(C5)C(=N)C

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2[N+]1(CC3=CC=C(C4=CC=CC=C34)C(=N)N)OC5CCNC(C5)C(=N)C

InChI

InChI=1S/C29H35N6O/c1-18(2)29-34-25-10-6-7-11-27(25)35(29,36-21-14-15-33-26(16-21)19(3)30)17-20-12-13-24(28(31)32)23-9-5-4-8-22(20)23/h4-13,18,21,26,30,33H,14-17H2,1-3H3,(H3,31,32)/q+1