3-[4-(4-chlorophenyl)-1-oxidanylidene-phthalazin-2-yl]-N-(2-morpholin-4-ium-4-ylethyl)propanamide

Systemtic Name: 3-[4-(4-chlorophenyl)-1-oxidanylidene-phthalazin-2-yl]-N-(2-morpholin-4-ium-4-ylethyl)propanamide Openeye Name: 3-[4-(4-chlorophenyl)-1-oxo-phthalazin-2-yl]-N-(2-morpholin-4-ium-4-ylethyl)propanamide CAS Name: 3-[4-(4-chlorophenyl)-1-oxo-2-phthalazinyl]-N-[2-(4-morpholin-4-iumyl)ethyl]propanamide IUPAC Name: 3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-(2-morpholin-4-ium-4-ylethyl)propanamide Traditional Name: 3-[4-(4-chlorophenyl)-1-keto-phthalazin-2-yl]-N-(2-morpholin-4-ium-4-ylethyl)propionamide Formula: C23H26ClN4O3+ MolecularWeight: 441.93054

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=O)CCN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1COCC[NH+]1CCNC(=O)CCN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H25ClN4O3/c24-18-7-5-17(6-8-18)22-19-3-1-2-4-20(19)23(30)28(26-22)11-9-21(29)25-10-12-27-13-15-31-16-14-27/h1-8H,9-16H2,(H,25,29)/p+1