3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-[4-(cyanomethyl)phenyl]propanamide

Systemtic Name: 3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-[4-(cyanomethyl)phenyl]propanamide Openeye Name: N-[4-(cyanomethyl)phenyl]-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide CAS Name: N-[4-(cyanomethyl)phenyl]-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide Traditional Name: N-[4-(cyanomethyl)phenyl]-3-(1,4-diketo-3H-phthalazin-2-yl)propionamide Formula: C19H16N4O3 MolecularWeight: 348.35534

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NN(C2=O)CCC(=O)NC3=CC=C(C=C3)CC#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NN(C2=O)CCC(=O)NC3=CC=C(C=C3)CC#N

InChI

InChI=1S/C19H16N4O3/c20-11-9-13-5-7-14(8-6-13)21-17(24)10-12-23-19(26)16-4-2-1-3-15(16)18(25)22-23/h1-8H,9-10,12H2,(H,21,24)(H,22,25)