ethyl 5-(3-methylbutanoylamino)-1-[2-(3-methylbutanoyloxy)ethyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-(3-methylbutanoylamino)-1-[2-(3-methylbutanoyloxy)ethyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-(3-methylbutanoylamino)-1-[2-(3-methylbutanoyloxy)ethyl]pyrazole-4-carboxylate CAS Name: 1-[2-(3-methyl-1-oxobutoxy)ethyl]-5-[(3-methyl-1-oxobutyl)amino]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(3-methylbutanoylamino)-1-[2-(3-methylbutanoyloxy)ethyl]pyrazole-4-carboxylate Traditional Name: 5-(isovalerylamino)-1-(2-isovaleryloxyethyl)pyrazole-4-carboxylic acid ethyl ester Formula: C18H29N3O5 MolecularWeight: 367.43996

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)CCOC(=O)CC(C)C)NC(=O)CC(C)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)CCOC(=O)CC(C)C)NC(=O)CC(C)C

InChI

InChI=1S/C18H29N3O5/c1-6-25-18(24)14-11-19-21(7-8-26-16(23)10-13(4)5)17(14)20-15(22)9-12(2)3/h11-13H,6-10H2,1-5H3,(H,20,22)