6-oxidanylidene-1-(phenylmethyl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-pyridazine-3-carboxamide

Systemtic Name: 6-oxidanylidene-1-(phenylmethyl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-pyridazine-3-carboxamide Openeye Name: 1-benzyl-6-oxo-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-pyridazine-3-carboxamide CAS Name: 6-oxo-1-(phenylmethyl)-N-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]yl)-3-pyridazinecarboxamide IUPAC Name: 1-benzyl-6-oxo-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylpyridazine-3-carboxamide Traditional Name: 1-benzyl-6-keto-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-pyridazine-3-carboxamide Formula: C23H21N3O4 MolecularWeight: 403.43054

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=O)C4=NN(C(=O)C=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=O)C4=NN(C(=O)C=C4)CC5=CC=CC=C5

InChI

InChI=1S/C23H21N3O4/c27-21-11-9-18(25-26(21)15-16-6-2-1-3-7-16)22(28)24-17-8-10-19-20(14-17)30-23(29-19)12-4-5-13-23/h1-3,6-11,14H,4-5,12-13,15H2,(H,24,28)