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4-(3,4-dimethoxyphenyl)-2-prop-2-ynyl-4a,5,6,7,8,8a-hexahydrophthalazin-1-one
4-(3,4-dimethoxyphenyl)-2-prop-2-ynyl-4a,5,6,7,8,8a-hexahydrophthalazin-1-one
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Descriptors Computed from Structure
Canonical SMILES:
COC1=C(C=C(C=C1)C2=NN(C(=O)C3C2CCCC3)CC#C)OC
Isomeric SMILES
COC1=C(C=C(C=C1)C2=NN(C(=O)C3C2CCCC3)CC#C)OC
InChI
InChI=1S/C19H22N2O3/c1-4-11-21-19(22)15-8-6-5-7-14(15)18(20-21)13-9-10-16(23-2)17(12-13)24-3/h1,9-10,12,14-15H,5-8,11H2,2-3H3
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