2-[4-(3-methyl-4-oxidanylidene-phthalazin-1-yl)phenoxy]-N-(2-morpholin-4-ium-4-ylethyl)ethanamide

Systemtic Name: 2-[4-(3-methyl-4-oxidanylidene-phthalazin-1-yl)phenoxy]-N-(2-morpholin-4-ium-4-ylethyl)ethanamide Openeye Name: 2-[4-(3-methyl-4-oxo-phthalazin-1-yl)phenoxy]-N-(2-morpholin-4-ium-4-ylethyl)acetamide CAS Name: 2-[4-(3-methyl-4-oxo-1-phthalazinyl)phenoxy]-N-[2-(4-morpholin-4-iumyl)ethyl]acetamide IUPAC Name: 2-[4-(3-methyl-4-oxophthalazin-1-yl)phenoxy]-N-(2-morpholin-4-ium-4-ylethyl)acetamide Traditional Name: 2-[4-(4-keto-3-methyl-phthalazin-1-yl)phenoxy]-N-(2-morpholin-4-ium-4-ylethyl)acetamide Formula: C23H27N4O4+ MolecularWeight: 423.48488

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C3=CC=C(C=C3)OCC(=O)NCC[NH+]4CCOCC4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C3=CC=C(C=C3)OCC(=O)NCC[NH+]4CCOCC4

InChI

InChI=1S/C23H26N4O4/c1-26-23(29)20-5-3-2-4-19(20)22(25-26)17-6-8-18(9-7-17)31-16-21(28)24-10-11-27-12-14-30-15-13-27/h2-9H,10-16H2,1H3,(H,24,28)/p+1