4-[2-[4-(4-chlorophenyl)-1-oxidanylidene-phthalazin-2-yl]ethanoylamino]-N,N-diethyl-benzamide

Systemtic Name: 4-[2-[4-(4-chlorophenyl)-1-oxidanylidene-phthalazin-2-yl]ethanoylamino]-N,N-diethyl-benzamide Openeye Name: 4-[[2-[4-(4-chlorophenyl)-1-oxo-phthalazin-2-yl]acetyl]amino]-N,N-diethyl-benzamide CAS Name: 4-[[2-[4-(4-chlorophenyl)-1-oxo-2-phthalazinyl]-1-oxoethyl]amino]-N,N-diethylbenzamide IUPAC Name: 4-[[2-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]acetyl]amino]-N,N-diethylbenzamide Traditional Name: 4-[[2-[4-(4-chlorophenyl)-1-keto-phthalazin-2-yl]acetyl]amino]-N,N-diethyl-benzamide Formula: C27H25ClN4O3 MolecularWeight: 488.9654

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C27H25ClN4O3/c1-3-31(4-2)26(34)19-11-15-21(16-12-19)29-24(33)17-32-27(35)23-8-6-5-7-22(23)25(30-32)18-9-13-20(28)14-10-18/h5-16H,3-4,17H2,1-2H3,(H,29,33)