ethyl 1-[4-(furan-2-ylmethylcarbamoyl)phenyl]-3,5-dimethyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[4-(furan-2-ylmethylcarbamoyl)phenyl]-3,5-dimethyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-[4-(2-furylmethylcarbamoyl)phenyl]-3,5-dimethyl-pyrazole-4-carboxylate CAS Name: 1-[4-[(2-furanylmethylamino)-oxomethyl]phenyl]-3,5-dimethyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-(furan-2-ylmethylcarbamoyl)phenyl]-3,5-dimethylpyrazole-4-carboxylate Traditional Name: 1-[4-(2-furfurylcarbamoyl)phenyl]-3,5-dimethyl-pyrazole-4-carboxylic acid ethyl ester Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1C)C2=CC=C(C=C2)C(=O)NCC3=CC=CO3)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1C)C2=CC=C(C=C2)C(=O)NCC3=CC=CO3)C

InChI

InChI=1S/C20H21N3O4/c1-4-26-20(25)18-13(2)22-23(14(18)3)16-9-7-15(8-10-16)19(24)21-12-17-6-5-11-27-17/h5-11H,4,12H2,1-3H3,(H,21,24)