4-[4-(4-hydroxyphenyl)carbonylpiperidin-1-yl]carbonyl-2-phenyl-phthalazin-1-one

Systemtic Name: 4-[4-(4-hydroxyphenyl)carbonylpiperidin-1-yl]carbonyl-2-phenyl-phthalazin-1-one Openeye Name: 4-[4-(4-hydroxybenzoyl)piperidine-1-carbonyl]-2-phenyl-phthalazin-1-one CAS Name: 4-[[4-[(4-hydroxyphenyl)-oxomethyl]-1-piperidinyl]-oxomethyl]-2-phenyl-1-phthalazinone IUPAC Name: 4-[4-(4-hydroxybenzoyl)piperidine-1-carbonyl]-2-phenylphthalazin-1-one Traditional Name: 4-[4-(4-hydroxybenzoyl)piperidine-1-carbonyl]-2-phenyl-phthalazin-1-one Formula: C27H23N3O4 MolecularWeight: 453.48922

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)C2=CC=C(C=C2)O)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)C2=CC=C(C=C2)O)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C27H23N3O4/c31-21-12-10-18(11-13-21)25(32)19-14-16-29(17-15-19)27(34)24-22-8-4-5-9-23(22)26(33)30(28-24)20-6-2-1-3-7-20/h1-13,19,31H,14-17H2