ethyl 4-(2-cyclopentylethanoylamino)-1-(4-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 4-(2-cyclopentylethanoylamino)-1-(4-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 4-[(2-cyclopentylacetyl)amino]-6-oxo-1-(p-tolyl)pyridazine-3-carboxylate CAS Name: 4-[(2-cyclopentyl-1-oxoethyl)amino]-1-(4-methylphenyl)-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2-cyclopentylacetyl)amino]-1-(4-methylphenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 4-[(2-cyclopentylacetyl)amino]-6-keto-1-(p-tolyl)pyridazine-3-carboxylic acid ethyl ester Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)CC2CCCC2)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)CC2CCCC2)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H25N3O4/c1-3-28-21(27)20-17(22-18(25)12-15-6-4-5-7-15)13-19(26)24(23-20)16-10-8-14(2)9-11-16/h8-11,13,15H,3-7,12H2,1-2H3,(H,22,25)