4-oxidanylidene-3-[2-oxidanyl-3-(2-prop-2-enylphenoxy)propyl]phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-[2-oxidanyl-3-(2-prop-2-enylphenoxy)propyl]phthalazine-1-carboxamide Openeye Name: 3-[3-(2-allylphenoxy)-2-hydroxy-propyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-[2-hydroxy-3-(2-prop-2-enylphenoxy)propyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-[2-hydroxy-3-(2-prop-2-enylphenoxy)propyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-[3-(2-allylphenoxy)-2-hydroxy-propyl]-4-keto-phthalazine-1-carboxamide Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC=C1OCC(CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)N)O

Isomeric SMILES

C=CCC1=CC=CC=C1OCC(CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)N)O

InChI

InChI=1S/C21H21N3O4/c1-2-7-14-8-3-6-11-18(14)28-13-15(25)12-24-21(27)17-10-5-4-9-16(17)19(23-24)20(22)26/h2-6,8-11,15,25H,1,7,12-13H2,(H2,22,26)