ethyl (1S,2S)-2-[[cyclohexylmethyl-(1,5-dimethylpyrazol-3-yl)carbonyl-amino]methyl]cyclopropane-1-carboxylate

Systemtic Name: ethyl (1S,2S)-2-[[cyclohexylmethyl-(1,5-dimethylpyrazol-3-yl)carbonyl-amino]methyl]cyclopropane-1-carboxylate Openeye Name: ethyl (1S,2S)-2-[[cyclohexylmethyl-(1,5-dimethylpyrazole-3-carbonyl)amino]methyl]cyclopropanecarboxylate CAS Name: (1S,2S)-2-[[cyclohexylmethyl-[(1,5-dimethyl-3-pyrazolyl)-oxomethyl]amino]methyl]-1-cyclopropanecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,2S)-2-[[cyclohexylmethyl-(1,5-dimethylpyrazole-3-carbonyl)amino]methyl]cyclopropane-1-carboxylate Traditional Name: (1S,2S)-2-[[cyclohexylmethyl-(1,5-dimethylpyrazole-3-carbonyl)amino]methyl]cyclopropanecarboxylic acid ethyl ester Formula: C20H31N3O3 MolecularWeight: 361.47844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC1CN(CC2CCCCC2)C(=O)C3=NN(C(=C3)C)C

Isomeric SMILES

CCOC(=O)[C@H]1C[C@@H]1CN(CC2CCCCC2)C(=O)C3=NN(C(=C3)C)C

InChI

InChI=1S/C20H31N3O3/c1-4-26-20(25)17-11-16(17)13-23(12-15-8-6-5-7-9-15)19(24)18-10-14(2)22(3)21-18/h10,15-17H,4-9,11-13H2,1-3H3/t16-,17+/m1/s1