1-[2-[2-oxidanylidene-5-[(E)-3-oxidanyloct-1-enyl]pyrrolidin-1-yl]ethyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-[2-[2-oxidanylidene-5-[(E)-3-oxidanyloct-1-enyl]pyrrolidin-1-yl]ethyl]pyrazole-4-carboxylic acid Openeye Name: 1-[2-[2-[(E)-3-hydroxyoct-1-enyl]-5-oxo-pyrrolidin-1-yl]ethyl]pyrazole-4-carboxylic acid CAS Name: 1-[2-[2-[(E)-3-hydroxyoct-1-enyl]-5-oxo-1-pyrrolidinyl]ethyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-[2-[2-[(E)-3-hydroxyoct-1-enyl]-5-oxopyrrolidin-1-yl]ethyl]pyrazole-4-carboxylic acid Traditional Name: 1-[2-[2-[(E)-3-hydroxyoct-1-enyl]-5-keto-pyrrolidino]ethyl]pyrazole-4-carboxylic acid Formula: C18H27N3O4 MolecularWeight: 349.42468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1CCC(=O)N1CCN2C=C(C=N2)C(=O)O)O

Isomeric SMILES

CCCCCC(/C=C/C1CCC(=O)N1CCN2C=C(C=N2)C(=O)O)O

InChI

InChI=1S/C18H27N3O4/c1-2-3-4-5-16(22)8-6-15-7-9-17(23)21(15)11-10-20-13-14(12-19-20)18(24)25/h6,8,12-13,15-16,22H,2-5,7,9-11H2,1H3,(H,24,25)/b8-6+