2-(6-tert-butyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]ethanamide

Systemtic Name: 2-(6-tert-butyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]ethanamide Openeye Name: 2-(6-tert-butyl-3-oxo-1,4-benzoxazin-4-yl)-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]acetamide CAS Name: 2-(6-tert-butyl-3-oxo-1,4-benzoxazin-4-yl)-N-[3-(4-methyl-1-piperidin-1-iumyl)propyl]acetamide IUPAC Name: 2-(6-tert-butyl-3-oxo-1,4-benzoxazin-4-yl)-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]acetamide Traditional Name: 2-(6-tert-butyl-3-keto-1,4-benzoxazin-4-yl)-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]acetamide Formula: C23H36N3O3+ MolecularWeight: 402.55024

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCCNC(=O)CN2C(=O)COC3=C2C=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1CC[NH+](CC1)CCCNC(=O)CN2C(=O)COC3=C2C=C(C=C3)C(C)(C)C

InChI

InChI=1S/C23H35N3O3/c1-17-8-12-25(13-9-17)11-5-10-24-21(27)15-26-19-14-18(23(2,3)4)6-7-20(19)29-16-22(26)28/h6-7,14,17H,5,8-13,15-16H2,1-4H3,(H,24,27)/p+1