5-(1,3-benzodioxol-4-ylmethylidene)-1-(3-chloranylpropyl)-3-cyclohexyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-(1,3-benzodioxol-4-ylmethylidene)-1-(3-chloranylpropyl)-3-cyclohexyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-(1,3-benzodioxol-4-ylmethylene)-1-(3-chloropropyl)-3-cyclohexyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-(1,3-benzodioxol-4-ylmethylidene)-1-(3-chloropropyl)-3-cyclohexyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-(1,3-benzodioxol-4-ylmethylidene)-1-(3-chloropropyl)-3-cyclohexyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-(1,3-benzodioxol-4-ylmethylene)-1-(3-chloropropyl)-3-cyclohexyl-barbituric acid Formula: C21H23ClN2O5 MolecularWeight: 418.87072

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C(=CC3=C4C(=CC=C3)OCO4)C(=O)N(C2=O)CCCCl

Isomeric SMILES

C1CCC(CC1)N2C(=O)C(=CC3=C4C(=CC=C3)OCO4)C(=O)N(C2=O)CCCCl

InChI

InChI=1S/C21H23ClN2O5/c22-10-5-11-23-19(25)16(12-14-6-4-9-17-18(14)29-13-28-17)20(26)24(21(23)27)15-7-2-1-3-8-15/h4,6,9,12,15H,1-3,5,7-8,10-11,13H2