2-[2-oxidanyl-3-(2-prop-2-enylphenoxy)propyl]-4-thiophen-2-yl-phthalazin-1-one

Systemtic Name: 2-[2-oxidanyl-3-(2-prop-2-enylphenoxy)propyl]-4-thiophen-2-yl-phthalazin-1-one Openeye Name: 2-[3-(2-allylphenoxy)-2-hydroxy-propyl]-4-(2-thienyl)phthalazin-1-one CAS Name: 2-[2-hydroxy-3-(2-prop-2-enylphenoxy)propyl]-4-thiophen-2-yl-1-phthalazinone IUPAC Name: 2-[2-hydroxy-3-(2-prop-2-enylphenoxy)propyl]-4-thiophen-2-ylphthalazin-1-one Traditional Name: 2-[3-(2-allylphenoxy)-2-hydroxy-propyl]-4-(2-thienyl)phthalazin-1-one Formula: C24H22N2O3S MolecularWeight: 418.50808

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC=C1OCC(CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=CS4)O

Isomeric SMILES

C=CCC1=CC=CC=C1OCC(CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=CS4)O

InChI

InChI=1S/C24H22N2O3S/c1-2-8-17-9-3-6-12-21(17)29-16-18(27)15-26-24(28)20-11-5-4-10-19(20)23(25-26)22-13-7-14-30-22/h2-7,9-14,18,27H,1,8,15-16H2