2-[3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]propanoylamino]-N-prop-2-enyl-benzamide

Systemtic Name: 2-[3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]propanoylamino]-N-prop-2-enyl-benzamide Openeye Name: N-allyl-2-[3-(1,4-dioxo-3H-phthalazin-2-yl)propanoylamino]benzamide CAS Name: 2-[[3-(1,4-dioxo-3H-phthalazin-2-yl)-1-oxopropyl]amino]-N-prop-2-enylbenzamide IUPAC Name: 2-[3-(1,4-dioxo-3H-phthalazin-2-yl)propanoylamino]-N-prop-2-enylbenzamide Traditional Name: N-allyl-2-[3-(1,4-diketo-3H-phthalazin-2-yl)propanoylamino]benzamide Formula: C21H20N4O4 MolecularWeight: 392.4079

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C1=CC=CC=C1NC(=O)CCN2C(=O)C3=CC=CC=C3C(=O)N2

Isomeric SMILES

C=CCNC(=O)C1=CC=CC=C1NC(=O)CCN2C(=O)C3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C21H20N4O4/c1-2-12-22-19(27)16-9-5-6-10-17(16)23-18(26)11-13-25-21(29)15-8-4-3-7-14(15)20(28)24-25/h2-10H,1,11-13H2,(H,22,27)(H,23,26)(H,24,28)