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(4aS,8aR)-2-cyclohexyl-4-(3,4-dimethoxyphenyl)-4a,5,8,8a-tetrahydrophthalazin-1-one
(4aS,8aR)-2-cyclohexyl-4-(3,4-dimethoxyphenyl)-4a,5,8,8a-tetrahydrophthalazin-1-one
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Canonical SMILES:
COC1=C(C=C(C=C1)C2=NN(C(=O)C3C2CC=CC3)C4CCCCC4)OC
Isomeric SMILES
COC1=C(C=C(C=C1)C2=NN(C(=O)[C@H]3[C@@H]2CC=CC3)C4CCCCC4)OC
InChI
InChI=1S/C22H28N2O3/c1-26-19-13-12-15(14-20(19)27-2)21-17-10-6-7-11-18(17)22(25)24(23-21)16-8-4-3-5-9-16/h6-7,12-14,16-18H,3-5,8-11H2,1-2H3/t17-,18+/m0/s1
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