1-[3-[(1,5-dimethylpyrazol-4-yl)methylamino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid

Systemtic Name: 1-[3-[(1,5-dimethylpyrazol-4-yl)methylamino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid Openeye Name: 1-[3-[(1,5-dimethylpyrazol-4-yl)methylamino]-3-oxo-propyl]pyrazole-3-carboxylic acid CAS Name: 1-[3-[(1,5-dimethyl-4-pyrazolyl)methylamino]-3-oxopropyl]-3-pyrazolecarboxylic acid IUPAC Name: 1-[3-[(1,5-dimethylpyrazol-4-yl)methylamino]-3-oxopropyl]pyrazole-3-carboxylic acid Traditional Name: 1-[3-[(1,5-dimethylpyrazol-4-yl)methylamino]-3-keto-propyl]pyrazole-3-carboxylic acid Formula: C13H17N5O3 MolecularWeight: 291.30578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)CNC(=O)CCN2C=CC(=N2)C(=O)O

Isomeric SMILES

CC1=C(C=NN1C)CNC(=O)CCN2C=CC(=N2)C(=O)O

InChI

InChI=1S/C13H17N5O3/c1-9-10(8-15-17(9)2)7-14-12(19)4-6-18-5-3-11(16-18)13(20)21/h3,5,8H,4,6-7H2,1-2H3,(H,14,19)(H,20,21)