N'-tert-butyl-3-(cyanomethyl)-N'-(3,5-dimethylphenyl)carbonyl-5-methyl-2,3-dihydro-1,4-benzodioxine-6-carbohydrazide

Systemtic Name: N'-tert-butyl-3-(cyanomethyl)-N'-(3,5-dimethylphenyl)carbonyl-5-methyl-2,3-dihydro-1,4-benzodioxine-6-carbohydrazide Openeye Name: N'-tert-butyl-3-(cyanomethyl)-N'-(3,5-dimethylbenzoyl)-5-methyl-2,3-dihydro-1,4-benzodioxine-6-carbohydrazide CAS Name: N'-tert-butyl-3-(cyanomethyl)-N'-[(3,5-dimethylphenyl)-oxomethyl]-5-methyl-2,3-dihydro-1,4-benzodioxin-6-carbohydrazide IUPAC Name: N'-tert-butyl-3-(cyanomethyl)-N'-(3,5-dimethylbenzoyl)-5-methyl-2,3-dihydro-1,4-benzodioxine-6-carbohydrazide Traditional Name: N'-tert-butyl-3-(cyanomethyl)-N'-(3,5-dimethylbenzoyl)-5-methyl-2,3-dihydro-1,4-benzodioxin-6-carbohydrazide Formula: C25H29N3O4 MolecularWeight: 435.51546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCC(O3)CC#N)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCC(O3)CC#N)C)C

InChI

InChI=1S/C25H29N3O4/c1-15-11-16(2)13-18(12-15)24(30)28(25(4,5)6)27-23(29)20-7-8-21-22(17(20)3)32-19(9-10-26)14-31-21/h7-8,11-13,19H,9,14H2,1-6H3,(H,27,29)