2-[4-[1-(3-chlorophenyl)imidazol-2-yl]piperazin-1-ium-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-[1-(3-chlorophenyl)imidazol-2-yl]piperazin-1-ium-1-yl]-N-propan-2-yl-ethanamide Openeye Name: 2-[4-[1-(3-chlorophenyl)imidazol-2-yl]piperazin-1-ium-1-yl]-N-isopropyl-acetamide CAS Name: 2-[4-[1-(3-chlorophenyl)-2-imidazolyl]-1-piperazin-1-iumyl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-[1-(3-chlorophenyl)imidazol-2-yl]piperazin-1-ium-1-yl]-N-propan-2-ylacetamide Traditional Name: 2-[4-[1-(3-chlorophenyl)imidazol-2-yl]piperazin-1-ium-1-yl]-N-isopropyl-acetamide Formula: C18H25ClN5O+ MolecularWeight: 362.877

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C[NH+]1CCN(CC1)C2=NC=CN2C3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C)NC(=O)C[NH+]1CCN(CC1)C2=NC=CN2C3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H24ClN5O/c1-14(2)21-17(25)13-22-8-10-23(11-9-22)18-20-6-7-24(18)16-5-3-4-15(19)12-16/h3-7,12,14H,8-11,13H2,1-2H3,(H,21,25)/p+1