N-tert-butyl-2-[4-[3-(2-oxidanylidene-1,3-benzoxazol-3-yl)propanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-[3-(2-oxidanylidene-1,3-benzoxazol-3-yl)propanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-[3-(2-oxo-1,3-benzoxazol-3-yl)propanoyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[1-oxo-3-(2-oxo-1,3-benzoxazol-3-yl)propyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-tert-butyl-2-[4-[3-(2-oxo-1,3-benzoxazol-3-yl)propanoyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-[3-(2-keto-1,3-benzoxazol-3-yl)propanoyl]piperazin-1-ium-1-yl]acetamide Formula: C20H29N4O4+ MolecularWeight: 389.46866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C[NH+]1CCN(CC1)C(=O)CCN2C3=CC=CC=C3OC2=O

Isomeric SMILES

CC(C)(C)NC(=O)C[NH+]1CCN(CC1)C(=O)CCN2C3=CC=CC=C3OC2=O

InChI

InChI=1S/C20H28N4O4/c1-20(2,3)21-17(25)14-22-10-12-23(13-11-22)18(26)8-9-24-15-6-4-5-7-16(15)28-19(24)27/h4-7H,8-14H2,1-3H3,(H,21,25)/p+1