propan-2-yl 8,8-dimethyl-5-oxidanylidene-7,9-dihydro-6H-pyridazino[4,3-c]azepine-3-carboxylate

Systemtic Name: propan-2-yl 8,8-dimethyl-5-oxidanylidene-7,9-dihydro-6H-pyridazino[4,3-c]azepine-3-carboxylate Openeye Name: isopropyl 8,8-dimethyl-5-oxo-7,9-dihydro-6H-pyridazino[4,3-c]azepine-3-carboxylate CAS Name: 8,8-dimethyl-5-oxo-7,9-dihydro-6H-pyridazino[4,3-c]azepine-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 8,8-dimethyl-5-oxo-7,9-dihydro-6H-pyridazino[4,3-c]azepine-3-carboxylate Traditional Name: 5-keto-8,8-dimethyl-7,9-dihydro-6H-pyridazin[4,3-c]azepine-3-carboxylic acid isopropyl ester Formula: C14H19N3O3 MolecularWeight: 277.31896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=NN=C2CC(CNC(=O)C2=C1)(C)C

Isomeric SMILES

CC(C)OC(=O)C1=NN=C2CC(CNC(=O)C2=C1)(C)C

InChI

InChI=1S/C14H19N3O3/c1-8(2)20-13(19)10-5-9-11(17-16-10)6-14(3,4)7-15-12(9)18/h5,8H,6-7H2,1-4H3,(H,15,18)