methyl (4S,5R)-4-ethyl-5-methyl-3,4-dihydropyrazole-5-carboxylate

Systemtic Name: methyl (4S,5R)-4-ethyl-5-methyl-3,4-dihydropyrazole-5-carboxylate Openeye Name: methyl (4S,5R)-4-ethyl-5-methyl-3,4-dihydropyrazole-5-carboxylate CAS Name: (4S,5R)-4-ethyl-5-methyl-3,4-dihydropyrazole-5-carboxylic acid methyl ester IUPAC Name: methyl (4S,5R)-4-ethyl-5-methyl-3,4-dihydropyrazole-5-carboxylate Traditional Name: (3R,4S)-4-ethyl-3-methyl-1-pyrazoline-3-carboxylic acid methyl ester Formula: C8H14N2O2 MolecularWeight: 170.20896

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN=NC1(C)C(=O)OC

Isomeric SMILES

CC[C@H]1CN=N[C@@]1(C)C(=O)OC

InChI

InChI=1S/C8H14N2O2/c1-4-6-5-9-10-8(6,2)7(11)12-3/h6H,4-5H2,1-3H3/t6-,8+/m0/s1