2-[3-(3-methoxypropylamino)-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid

Systemtic Name: 2-[3-(3-methoxypropylamino)-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid Openeye Name: 2-[3-(3-methoxypropylamino)-3-oxo-propyl]pyrazole-3-carboxylic acid CAS Name: 2-[3-(3-methoxypropylamino)-3-oxopropyl]-3-pyrazolecarboxylic acid IUPAC Name: 2-[3-(3-methoxypropylamino)-3-oxopropyl]pyrazole-3-carboxylic acid Traditional Name: 2-[3-keto-3-(3-methoxypropylamino)propyl]pyrazole-3-carboxylic acid Formula: C11H17N3O4 MolecularWeight: 255.27038

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)CCN1C(=CC=N1)C(=O)O

Isomeric SMILES

COCCCNC(=O)CCN1C(=CC=N1)C(=O)O

InChI

InChI=1S/C11H17N3O4/c1-18-8-2-5-12-10(15)4-7-14-9(11(16)17)3-6-13-14/h3,6H,2,4-5,7-8H2,1H3,(H,12,15)(H,16,17)