2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-[3-(pyrrolidin-1-ylmethyl)phenyl]ethanamide

Systemtic Name: 2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-[3-(pyrrolidin-1-ylmethyl)phenyl]ethanamide Openeye Name: 2-(1,4-dioxo-3H-phthalazin-2-yl)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]acetamide CAS Name: 2-(1,4-dioxo-3H-phthalazin-2-yl)-N-[3-(1-pyrrolidinylmethyl)phenyl]acetamide IUPAC Name: 2-(1,4-dioxo-3H-phthalazin-2-yl)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]acetamide Traditional Name: 2-(1,4-diketo-3H-phthalazin-2-yl)-N-[3-(pyrrolidinomethyl)phenyl]acetamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC(=CC=C2)NC(=O)CN3C(=O)C4=CC=CC=C4C(=O)N3

Isomeric SMILES

C1CCN(C1)CC2=CC(=CC=C2)NC(=O)CN3C(=O)C4=CC=CC=C4C(=O)N3

InChI

InChI=1S/C21H22N4O3/c26-19(14-25-21(28)18-9-2-1-8-17(18)20(27)23-25)22-16-7-5-6-15(12-16)13-24-10-3-4-11-24/h1-2,5-9,12H,3-4,10-11,13-14H2,(H,22,26)(H,23,27)