ethyl 1-methyl-5-[6-(methylamino)-7-oxidanylidene-cyclohepta-1,3,5-trien-1-yl]pyrazole-3-carboxylate

Systemtic Name: ethyl 1-methyl-5-[6-(methylamino)-7-oxidanylidene-cyclohepta-1,3,5-trien-1-yl]pyrazole-3-carboxylate Openeye Name: ethyl 1-methyl-5-[6-(methylamino)-7-oxo-cyclohepta-1,3,5-trien-1-yl]pyrazole-3-carboxylate CAS Name: 1-methyl-5-[6-(methylamino)-7-oxo-1-cyclohepta-1,3,5-trienyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-methyl-5-[6-(methylamino)-7-oxocyclohepta-1,3,5-trien-1-yl]pyrazole-3-carboxylate Traditional Name: 5-[7-keto-6-(methylamino)cyclohepta-1,3,5-trien-1-yl]-1-methyl-pyrazole-3-carboxylic acid ethyl ester Formula: C15H17N3O3 MolecularWeight: 287.31378

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)C2=CC=CC=C(C2=O)NC)C

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)C2=CC=CC=C(C2=O)NC)C

InChI

InChI=1S/C15H17N3O3/c1-4-21-15(20)12-9-13(18(3)17-12)10-7-5-6-8-11(16-2)14(10)19/h5-9H,4H2,1-3H3,(H,16,19)