ethyl 5-[(5-butyl-2-oxidanylidene-5-phenyl-oxolan-3-yl)amino]-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[(5-butyl-2-oxidanylidene-5-phenyl-oxolan-3-yl)amino]-1H-pyrazole-4-carboxylate Openeye Name: ethyl 5-[(5-butyl-2-oxo-5-phenyl-tetrahydrofuran-3-yl)amino]-1H-pyrazole-4-carboxylate CAS Name: 5-[(5-butyl-2-oxo-5-phenyl-3-oxolanyl)amino]-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(5-butyl-2-oxo-5-phenyloxolan-3-yl)amino]-1H-pyrazole-4-carboxylate Traditional Name: 5-[(5-butyl-2-keto-5-phenyl-tetrahydrofuran-3-yl)amino]-1H-pyrazole-4-carboxylic acid ethyl ester Formula: C20H25N3O4 MolecularWeight: 371.4302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CC(C(=O)O1)NC2=C(C=NN2)C(=O)OCC)C3=CC=CC=C3

Isomeric SMILES

CCCCC1(CC(C(=O)O1)NC2=C(C=NN2)C(=O)OCC)C3=CC=CC=C3

InChI

InChI=1S/C20H25N3O4/c1-3-5-11-20(14-9-7-6-8-10-14)12-16(19(25)27-20)22-17-15(13-21-23-17)18(24)26-4-2/h6-10,13,16H,3-5,11-12H2,1-2H3,(H2,21,22,23)