2-[3-oxidanylidene-3-(1-phenylethylamino)propyl]pyrazole-3-carboxylic acid

Systemtic Name: 2-[3-oxidanylidene-3-(1-phenylethylamino)propyl]pyrazole-3-carboxylic acid Openeye Name: 2-[3-oxo-3-(1-phenylethylamino)propyl]pyrazole-3-carboxylic acid CAS Name: 2-[3-oxo-3-(1-phenylethylamino)propyl]-3-pyrazolecarboxylic acid IUPAC Name: 2-[3-oxo-3-(1-phenylethylamino)propyl]pyrazole-3-carboxylic acid Traditional Name: 2-[3-keto-3-(1-phenylethylamino)propyl]pyrazole-3-carboxylic acid Formula: C15H17N3O3 MolecularWeight: 287.31378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)CCN2C(=CC=N2)C(=O)O

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)CCN2C(=CC=N2)C(=O)O

InChI

InChI=1S/C15H17N3O3/c1-11(12-5-3-2-4-6-12)17-14(19)8-10-18-13(15(20)21)7-9-16-18/h2-7,9,11H,8,10H2,1H3,(H,17,19)(H,20,21)