6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2-(2-pyrrolidin-1-ylethyl)phthalazin-1-one

Systemtic Name: 6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2-(2-pyrrolidin-1-ylethyl)phthalazin-1-one Openeye Name: 6-[(E)-2-(4-hydroxyphenyl)vinyl]-2-(2-pyrrolidin-1-ylethyl)phthalazin-1-one CAS Name: 6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2-[2-(1-pyrrolidinyl)ethyl]-1-phthalazinone IUPAC Name: 6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2-(2-pyrrolidin-1-ylethyl)phthalazin-1-one Traditional Name: 6-[(E)-2-(4-hydroxyphenyl)vinyl]-2-(2-pyrrolidinoethyl)phthalazin-1-one Formula: C22H23N3O2 MolecularWeight: 361.43692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCN2C(=O)C3=C(C=C(C=C3)C=CC4=CC=C(C=C4)O)C=N2

Isomeric SMILES

C1CCN(C1)CCN2C(=O)C3=C(C=C(C=C3)/C=C/C4=CC=C(C=C4)O)C=N2

InChI

InChI=1S/C22H23N3O2/c26-20-8-5-17(6-9-20)3-4-18-7-10-21-19(15-18)16-23-25(22(21)27)14-13-24-11-1-2-12-24/h3-10,15-16,26H,1-2,11-14H2/b4-3+