2-[3-[(2-methoxyphenyl)methoxy]-2-oxidanyl-propyl]-4-thiophen-2-yl-phthalazin-1-one

Systemtic Name: 2-[3-[(2-methoxyphenyl)methoxy]-2-oxidanyl-propyl]-4-thiophen-2-yl-phthalazin-1-one Openeye Name: 2-[2-hydroxy-3-[(2-methoxyphenyl)methoxy]propyl]-4-(2-thienyl)phthalazin-1-one CAS Name: 2-[2-hydroxy-3-[(2-methoxyphenyl)methoxy]propyl]-4-thiophen-2-yl-1-phthalazinone IUPAC Name: 2-[2-hydroxy-3-[(2-methoxyphenyl)methoxy]propyl]-4-thiophen-2-ylphthalazin-1-one Traditional Name: 2-(2-hydroxy-3-o-anisyloxy-propyl)-4-(2-thienyl)phthalazin-1-one Formula: C23H22N2O4S MolecularWeight: 422.49678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1COCC(CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=CS4)O

Isomeric SMILES

COC1=CC=CC=C1COCC(CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=CS4)O

InChI

InChI=1S/C23H22N2O4S/c1-28-20-10-5-2-7-16(20)14-29-15-17(26)13-25-23(27)19-9-4-3-8-18(19)22(24-25)21-11-6-12-30-21/h2-12,17,26H,13-15H2,1H3