(4-oxidanylidene-4-thiophen-2-yl-butyl) 2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoate

Systemtic Name: (4-oxidanylidene-4-thiophen-2-yl-butyl) 2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoate Openeye Name: [4-oxo-4-(2-thienyl)butyl] 2-(4-oxo-3H-phthalazin-1-yl)acetate CAS Name: 2-(4-oxo-3H-phthalazin-1-yl)acetic acid (4-oxo-4-thiophen-2-ylbutyl) ester IUPAC Name: (4-oxo-4-thiophen-2-ylbutyl) 2-(4-oxo-3H-phthalazin-1-yl)acetate Traditional Name: 2-(4-keto-3H-phthalazin-1-yl)acetic acid [4-keto-4-(2-thienyl)butyl] ester Formula: C18H16N2O4S MolecularWeight: 356.39564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)CC(=O)OCCCC(=O)C3=CC=CS3

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)CC(=O)OCCCC(=O)C3=CC=CS3

InChI

InChI=1S/C18H16N2O4S/c21-15(16-8-4-10-25-16)7-3-9-24-17(22)11-14-12-5-1-2-6-13(12)18(23)20-19-14/h1-2,4-6,8,10H,3,7,9,11H2,(H,20,23)