5-[(1,3-benzodioxol-5-ylamino)methylidene]-1-cycloheptyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(1,3-benzodioxol-5-ylamino)methylidene]-1-cycloheptyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(1,3-benzodioxol-5-ylamino)methylene]-1-cycloheptyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(1,3-benzodioxol-5-ylamino)methylidene]-1-cycloheptyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(1,3-benzodioxol-5-ylamino)methylidene]-1-cycloheptyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-[(1,3-benzodioxol-5-ylamino)methylene]-1-cycloheptyl-barbituric acid Formula: C19H21N3O5 MolecularWeight: 371.38714

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)N2C(=O)C(=CNC3=CC4=C(C=C3)OCO4)C(=O)NC2=O

Isomeric SMILES

C1CCCC(CC1)N2C(=O)C(=CNC3=CC4=C(C=C3)OCO4)C(=O)NC2=O

InChI

InChI=1S/C19H21N3O5/c23-17-14(10-20-12-7-8-15-16(9-12)27-11-26-15)18(24)22(19(25)21-17)13-5-3-1-2-4-6-13/h7-10,13,20H,1-6,11H2,(H,21,23,25)