N,N-diethyl-4-[3-[4-(4-methylphenyl)-1-oxidanylidene-phthalazin-2-yl]propanoylamino]benzamide

Systemtic Name: N,N-diethyl-4-[3-[4-(4-methylphenyl)-1-oxidanylidene-phthalazin-2-yl]propanoylamino]benzamide Openeye Name: N,N-diethyl-4-[3-[1-oxo-4-(p-tolyl)phthalazin-2-yl]propanoylamino]benzamide CAS Name: N,N-diethyl-4-[[3-[4-(4-methylphenyl)-1-oxo-2-phthalazinyl]-1-oxopropyl]amino]benzamide IUPAC Name: N,N-diethyl-4-[3-[4-(4-methylphenyl)-1-oxophthalazin-2-yl]propanoylamino]benzamide Traditional Name: N,N-diethyl-4-[3-[1-keto-4-(p-tolyl)phthalazin-2-yl]propanoylamino]benzamide Formula: C29H30N4O3 MolecularWeight: 482.5735

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CCN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)C

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CCN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)C

InChI

InChI=1S/C29H30N4O3/c1-4-32(5-2)28(35)22-14-16-23(17-15-22)30-26(34)18-19-33-29(36)25-9-7-6-8-24(25)27(31-33)21-12-10-20(3)11-13-21/h6-17H,4-5,18-19H2,1-3H3,(H,30,34)