N-tert-butyl-2-[4-[(2-oxidanylidene-1,3-benzoxazol-3-yl)methyl]piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-[(2-oxidanylidene-1,3-benzoxazol-3-yl)methyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-[(2-oxo-1,3-benzoxazol-3-yl)methyl]piperazine-1,4-diium-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[(2-oxo-1,3-benzoxazol-3-yl)methyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-tert-butyl-2-[4-[(2-oxo-1,3-benzoxazol-3-yl)methyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-[(2-keto-1,3-benzoxazol-3-yl)methyl]piperazine-1,4-diium-1-yl]acetamide Formula: C18H28N4O3+2 MolecularWeight: 348.43992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C[NH+]1CC[NH+](CC1)CN2C3=CC=CC=C3OC2=O

Isomeric SMILES

CC(C)(C)NC(=O)C[NH+]1CC[NH+](CC1)CN2C3=CC=CC=C3OC2=O

InChI

InChI=1S/C18H26N4O3/c1-18(2,3)19-16(23)12-20-8-10-21(11-9-20)13-22-14-6-4-5-7-15(14)25-17(22)24/h4-7H,8-13H2,1-3H3,(H,19,23)/p+2