N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-6-oxidanylidene-1H-pyridazine-3-carboxamide

Systemtic Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-6-oxidanylidene-1H-pyridazine-3-carboxamide Openeye Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-6-oxo-1H-pyridazine-3-carboxamide CAS Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-6-oxo-1H-pyridazine-3-carboxamide IUPAC Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-6-oxo-1H-pyridazine-3-carboxamide Traditional Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-6-keto-1H-pyridazine-3-carboxamide Formula: C16H17N3O4 MolecularWeight: 315.32388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCCO2)NC(=O)C3=NNC(=O)C=C3

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCCCO2)NC(=O)C3=NNC(=O)C=C3

InChI

InChI=1S/C16H17N3O4/c1-10(17-16(21)12-4-6-15(20)19-18-12)11-3-5-13-14(9-11)23-8-2-7-22-13/h3-6,9-10H,2,7-8H2,1H3,(H,17,21)(H,19,20)