N-(3-chloranyl-2,6-diethyl-phenyl)-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-(3-chloranyl-2,6-diethyl-phenyl)-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(3-chloro-2,6-diethyl-phenyl)-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-(3-chloro-2,6-diethylphenyl)-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(3-chloro-2,6-diethylphenyl)-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-(3-chloro-2,6-diethyl-phenyl)-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C20H20ClN3O2 MolecularWeight: 369.8447

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

Isomeric SMILES

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C20H20ClN3O2/c1-4-12-10-11-16(21)13(5-2)17(12)22-19(25)18-14-8-6-7-9-15(14)20(26)24(3)23-18/h6-11H,4-5H2,1-3H3,(H,22,25)