(1R,6S)-6-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl-methyl-carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: (1R,6S)-6-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl-methyl-carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: (1R,6S)-6-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl-methyl-carbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: (1R,6S)-6-[[(1-ethyl-3,5-dimethyl-4-pyrazolyl)methyl-methylamino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: (1R,6S)-6-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl-methylcarbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: (1R,6S)-6-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl-methyl-carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C17H25N3O3 MolecularWeight: 319.3987

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)CN(C)C(=O)C2CC=CCC2C(=O)O)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)CN(C)C(=O)[C@H]2CC=CC[C@H]2C(=O)O)C

InChI

InChI=1S/C17H25N3O3/c1-5-20-12(3)15(11(2)18-20)10-19(4)16(21)13-8-6-7-9-14(13)17(22)23/h6-7,13-14H,5,8-10H2,1-4H3,(H,22,23)/t13-,14+/m0/s1