1-methyl-5-[[3-(morpholin-4-ylmethyl)phenyl]carbamoyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-methyl-5-[[3-(morpholin-4-ylmethyl)phenyl]carbamoyl]pyrazole-4-carboxylic acid Openeye Name: 1-methyl-5-[[3-(morpholinomethyl)phenyl]carbamoyl]pyrazole-4-carboxylic acid CAS Name: 1-methyl-5-[[3-(4-morpholinylmethyl)anilino]-oxomethyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-methyl-5-[[3-(morpholin-4-ylmethyl)phenyl]carbamoyl]pyrazole-4-carboxylic acid Traditional Name: 1-methyl-5-[[3-(morpholinomethyl)phenyl]carbamoyl]pyrazole-4-carboxylic acid Formula: C17H20N4O4 MolecularWeight: 344.3651

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)O)C(=O)NC2=CC=CC(=C2)CN3CCOCC3

Isomeric SMILES

CN1C(=C(C=N1)C(=O)O)C(=O)NC2=CC=CC(=C2)CN3CCOCC3

InChI

InChI=1S/C17H20N4O4/c1-20-15(14(10-18-20)17(23)24)16(22)19-13-4-2-3-12(9-13)11-21-5-7-25-8-6-21/h2-4,9-10H,5-8,11H2,1H3,(H,19,22)(H,23,24)