N-(5-chloranyl-2-morpholin-4-yl-phenyl)-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-(5-chloranyl-2-morpholin-4-yl-phenyl)-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-(5-chloro-2-morpholino-phenyl)-4-oxo-phthalazine-1-carboxamide CAS Name: N-[5-chloro-2-(4-morpholinyl)phenyl]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-(5-chloro-2-morpholin-4-ylphenyl)-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-(5-chloro-2-morpholino-phenyl)-4-keto-phthalazine-1-carboxamide Formula: C26H23ClN4O3 MolecularWeight: 474.93882

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)Cl)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)Cl)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C26H23ClN4O3/c27-19-10-11-23(30-12-14-34-15-13-30)22(16-19)28-25(32)24-20-8-4-5-9-21(20)26(33)31(29-24)17-18-6-2-1-3-7-18/h1-11,16H,12-15,17H2,(H,28,32)