N-[[3-(methoxymethyl)phenyl]methyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide

Systemtic Name: N-[[3-(methoxymethyl)phenyl]methyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-[[3-(methoxymethyl)phenyl]methyl]-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-[[3-(methoxymethyl)phenyl]methyl]-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-[[3-(methoxymethyl)phenyl]methyl]-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-4-keto-N-[3-(methoxymethyl)benzyl]phthalazine-1-carboxamide Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC(=CC=C3)COC

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC(=CC=C3)COC

InChI

InChI=1S/C23H27N3O3/c1-3-4-7-13-26-23(28)20-12-6-5-11-19(20)21(25-26)22(27)24-15-17-9-8-10-18(14-17)16-29-2/h5-6,8-12,14H,3-4,7,13,15-16H2,1-2H3,(H,24,27)