2-[3-[1-(1,3-dimethylpyrazol-4-yl)ethylamino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid

Systemtic Name: 2-[3-[1-(1,3-dimethylpyrazol-4-yl)ethylamino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid Openeye Name: 2-[3-[1-(1,3-dimethylpyrazol-4-yl)ethylamino]-3-oxo-propyl]pyrazole-3-carboxylic acid CAS Name: 2-[3-[1-(1,3-dimethyl-4-pyrazolyl)ethylamino]-3-oxopropyl]-3-pyrazolecarboxylic acid IUPAC Name: 2-[3-[1-(1,3-dimethylpyrazol-4-yl)ethylamino]-3-oxopropyl]pyrazole-3-carboxylic acid Traditional Name: 2-[3-[1-(1,3-dimethylpyrazol-4-yl)ethylamino]-3-keto-propyl]pyrazole-3-carboxylic acid Formula: C14H19N5O3 MolecularWeight: 305.33236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C(C)NC(=O)CCN2C(=CC=N2)C(=O)O)C

Isomeric SMILES

CC1=NN(C=C1C(C)NC(=O)CCN2C(=CC=N2)C(=O)O)C

InChI

InChI=1S/C14H19N5O3/c1-9(11-8-18(3)17-10(11)2)16-13(20)5-7-19-12(14(21)22)4-6-15-19/h4,6,8-9H,5,7H2,1-3H3,(H,16,20)(H,21,22)