6-[[3-(cyclohexylcarbamoyl)-1-ethyl-pyrazol-4-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[[3-(cyclohexylcarbamoyl)-1-ethyl-pyrazol-4-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[[3-(cyclohexylcarbamoyl)-1-ethyl-pyrazol-4-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[[[3-[(cyclohexylamino)-oxomethyl]-1-ethyl-4-pyrazolyl]amino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[[3-(cyclohexylcarbamoyl)-1-ethylpyrazol-4-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[[3-(cyclohexylcarbamoyl)-1-ethyl-pyrazol-4-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C20H28N4O4 MolecularWeight: 388.46072

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC2CCCCC2)NC(=O)C3CC=CCC3C(=O)O

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC2CCCCC2)NC(=O)C3CC=CCC3C(=O)O

InChI

InChI=1S/C20H28N4O4/c1-2-24-12-16(17(23-24)19(26)21-13-8-4-3-5-9-13)22-18(25)14-10-6-7-11-15(14)20(27)28/h6-7,12-15H,2-5,8-11H2,1H3,(H,21,26)(H,22,25)(H,27,28)