2-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-5,6-dimethyl-3-oxidanylidene-pyridazine-4-carbonitrile

Systemtic Name: 2-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-5,6-dimethyl-3-oxidanylidene-pyridazine-4-carbonitrile Openeye Name: 2-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-5,6-dimethyl-3-oxo-pyridazine-4-carbonitrile CAS Name: 2-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-5,6-dimethyl-3-oxo-4-pyridazinecarbonitrile IUPAC Name: 2-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-5,6-dimethyl-3-oxopyridazine-4-carbonitrile Traditional Name: 2-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-keto-5,6-dimethyl-pyridazine-4-carbonitrile Formula: C17H16ClN3O3 MolecularWeight: 345.78024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)CC2=CC3=C(C(=C2)Cl)OCCCO3)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)CC2=CC3=C(C(=C2)Cl)OCCCO3)C#N

InChI

InChI=1S/C17H16ClN3O3/c1-10-11(2)20-21(17(22)13(10)8-19)9-12-6-14(18)16-15(7-12)23-4-3-5-24-16/h6-7H,3-5,9H2,1-2H3