4-butoxy-N-[4-(4-methyl-1-oxidanylidene-phthalazin-2-yl)phenyl]benzamide

Systemtic Name: 4-butoxy-N-[4-(4-methyl-1-oxidanylidene-phthalazin-2-yl)phenyl]benzamide Openeye Name: 4-butoxy-N-[4-(4-methyl-1-oxo-phthalazin-2-yl)phenyl]benzamide CAS Name: 4-butoxy-N-[4-(4-methyl-1-oxo-2-phthalazinyl)phenyl]benzamide IUPAC Name: 4-butoxy-N-[4-(4-methyl-1-oxophthalazin-2-yl)phenyl]benzamide Traditional Name: 4-butoxy-N-[4-(1-keto-4-methyl-phthalazin-2-yl)phenyl]benzamide Formula: C26H25N3O3 MolecularWeight: 427.495

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C(=N3)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C(=N3)C

InChI

InChI=1S/C26H25N3O3/c1-3-4-17-32-22-15-9-19(10-16-22)25(30)27-20-11-13-21(14-12-20)29-26(31)24-8-6-5-7-23(24)18(2)28-29/h5-16H,3-4,17H2,1-2H3,(H,27,30)