6-[(4-ethoxycarbonyl-1H-pyrazol-5-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[(4-ethoxycarbonyl-1H-pyrazol-5-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[(4-ethoxycarbonyl-1H-pyrazol-5-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[[(4-ethoxycarbonyl-1H-pyrazol-5-yl)amino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[(4-ethoxycarbonyl-1H-pyrazol-5-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[(4-carbethoxy-1H-pyrazol-5-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C14H17N3O5 MolecularWeight: 307.30188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN=C1)NC(=O)C2CC=CCC2C(=O)O

Isomeric SMILES

CCOC(=O)C1=C(NN=C1)NC(=O)C2CC=CCC2C(=O)O

InChI

InChI=1S/C14H17N3O5/c1-2-22-14(21)10-7-15-17-11(10)16-12(18)8-5-3-4-6-9(8)13(19)20/h3-4,7-9H,2,5-6H2,1H3,(H,19,20)(H2,15,16,17,18)