4-(3-chloranyl-4-methoxy-phenyl)-2-(1-morpholin-4-ylcarbonylpiperidin-4-yl)-4a,5,8,8a-tetrahydrophthalazin-1-one

Systemtic Name: 4-(3-chloranyl-4-methoxy-phenyl)-2-(1-morpholin-4-ylcarbonylpiperidin-4-yl)-4a,5,8,8a-tetrahydrophthalazin-1-one Openeye Name: 4-(3-chloro-4-methoxy-phenyl)-2-[1-(morpholine-4-carbonyl)-4-piperidyl]-4a,5,8,8a-tetrahydrophthalazin-1-one CAS Name: 4-(3-chloro-4-methoxyphenyl)-2-[1-[4-morpholinyl(oxo)methyl]-4-piperidinyl]-4a,5,8,8a-tetrahydrophthalazin-1-one IUPAC Name: 4-(3-chloro-4-methoxyphenyl)-2-[1-(morpholine-4-carbonyl)piperidin-4-yl]-4a,5,8,8a-tetrahydrophthalazin-1-one Traditional Name: 4-(3-chloro-4-methoxy-phenyl)-2-[1-(morpholine-4-carbonyl)-4-piperidyl]-4a,5,8,8a-tetrahydrophthalazin-1-one Formula: C25H31ClN4O4 MolecularWeight: 486.99104

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C(=O)C3C2CC=CC3)C4CCN(CC4)C(=O)N5CCOCC5)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C(=O)C3C2CC=CC3)C4CCN(CC4)C(=O)N5CCOCC5)Cl

InChI

InChI=1S/C25H31ClN4O4/c1-33-22-7-6-17(16-21(22)26)23-19-4-2-3-5-20(19)24(31)30(27-23)18-8-10-28(11-9-18)25(32)29-12-14-34-15-13-29/h2-3,6-7,16,18-20H,4-5,8-15H2,1H3