ethyl N-[2-[(4-ethanoylpiperazin-1-ium-1-yl)methyl]-1-methyl-benzimidazol-5-yl]carbamate

Systemtic Name: ethyl N-[2-[(4-ethanoylpiperazin-1-ium-1-yl)methyl]-1-methyl-benzimidazol-5-yl]carbamate Openeye Name: ethyl N-[2-[(4-acetylpiperazin-1-ium-1-yl)methyl]-1-methyl-benzimidazol-5-yl]carbamate CAS Name: N-[2-[(4-acetyl-1-piperazin-1-iumyl)methyl]-1-methyl-5-benzimidazolyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-[(4-acetylpiperazin-1-ium-1-yl)methyl]-1-methylbenzimidazol-5-yl]carbamate Traditional Name: N-[2-[(4-acetylpiperazin-1-ium-1-yl)methyl]-1-methyl-benzimidazol-5-yl]carbamic acid ethyl ester Formula: C18H26N5O3+ MolecularWeight: 360.43074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N5O3/c1-4-26-18(25)19-14-5-6-16-15(11-14)20-17(21(16)3)12-22-7-9-23(10-8-22)13(2)24/h5-6,11H,4,7-10,12H2,1-3H3,(H,19,25)/p+1