3-[(E)-oct-2-enyl]-1-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)methyl]phenyl]pyrrolidine-2,5-dione

Systemtic Name: 3-[(E)-oct-2-enyl]-1-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)methyl]phenyl]pyrrolidine-2,5-dione Openeye Name: 3-[(E)-oct-2-enyl]-1-[3-[(4-oxo-3H-phthalazin-1-yl)methyl]phenyl]pyrrolidine-2,5-dione CAS Name: 3-[(E)-oct-2-enyl]-1-[3-[(4-oxo-3H-phthalazin-1-yl)methyl]phenyl]pyrrolidine-2,5-dione IUPAC Name: 3-[(E)-oct-2-enyl]-1-[3-[(4-oxo-3H-phthalazin-1-yl)methyl]phenyl]pyrrolidine-2,5-dione Traditional Name: 1-[3-[(4-keto-3H-phthalazin-1-yl)methyl]phenyl]-3-[(E)-oct-2-enyl]pyrrolidine-2,5-quinone Formula: C27H29N3O3 MolecularWeight: 443.53746

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC1CC(=O)N(C1=O)C2=CC=CC(=C2)CC3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

CCCCC/C=C/CC1CC(=O)N(C1=O)C2=CC=CC(=C2)CC3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C27H29N3O3/c1-2-3-4-5-6-7-12-20-18-25(31)30(27(20)33)21-13-10-11-19(16-21)17-24-22-14-8-9-15-23(22)26(32)29-28-24/h6-11,13-16,20H,2-5,12,17-18H2,1H3,(H,29,32)/b7-6+