N-(1,3-benzodioxol-5-yl)-2-[4-(2,5-dimethylphenyl)-1-oxidanylidene-phthalazin-2-yl]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[4-(2,5-dimethylphenyl)-1-oxidanylidene-phthalazin-2-yl]propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[4-(2,5-dimethylphenyl)-1-oxo-phthalazin-2-yl]propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[4-(2,5-dimethylphenyl)-1-oxo-2-phthalazinyl]propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[4-(2,5-dimethylphenyl)-1-oxophthalazin-2-yl]propanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[4-(2,5-dimethylphenyl)-1-keto-phthalazin-2-yl]propionamide Formula: C26H23N3O4 MolecularWeight: 441.47852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=NN(C(=O)C3=CC=CC=C32)C(C)C(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=NN(C(=O)C3=CC=CC=C32)C(C)C(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H23N3O4/c1-15-8-9-16(2)21(12-15)24-19-6-4-5-7-20(19)26(31)29(28-24)17(3)25(30)27-18-10-11-22-23(13-18)33-14-32-22/h4-13,17H,14H2,1-3H3,(H,27,30)