N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-oxo-1-(2-phenoxyethyl)-3-pyridazinecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide Traditional Name: N-homopiperonyl-6-keto-1-(2-phenoxyethyl)pyridazine-3-carboxamide Formula: C22H21N3O5 MolecularWeight: 407.41924

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCNC(=O)C3=NN(C(=O)C=C3)CCOC4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCNC(=O)C3=NN(C(=O)C=C3)CCOC4=CC=CC=C4

InChI

InChI=1S/C22H21N3O5/c26-21-9-7-18(24-25(21)12-13-28-17-4-2-1-3-5-17)22(27)23-11-10-16-6-8-19-20(14-16)30-15-29-19/h1-9,14H,10-13,15H2,(H,23,27)