N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-[[2-(morpholinomethyl)phenyl]methyl]-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-[[2-(4-morpholinylmethyl)phenyl]methyl]-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: 4-keto-N-[2-(morpholinomethyl)benzyl]-3-phenyl-phthalazine-1-carboxamide Formula: C27H26N4O3 MolecularWeight: 454.52034

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=CC=CC=C2CNC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C1COCCN1CC2=CC=CC=C2CNC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C27H26N4O3/c32-26(28-18-20-8-4-5-9-21(20)19-30-14-16-34-17-15-30)25-23-12-6-7-13-24(23)27(33)31(29-25)22-10-2-1-3-11-22/h1-13H,14-19H2,(H,28,32)