2-[3-[(4-acetamidophenyl)amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid

Systemtic Name: 2-[3-[(4-acetamidophenyl)amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid Openeye Name: 2-[3-(4-acetamidoanilino)-3-oxo-propyl]pyrazole-3-carboxylic acid CAS Name: 2-[3-(4-acetamidoanilino)-3-oxopropyl]-3-pyrazolecarboxylic acid IUPAC Name: 2-[3-(4-acetamidoanilino)-3-oxopropyl]pyrazole-3-carboxylic acid Traditional Name: 2-[3-(4-acetamidoanilino)-3-keto-propyl]pyrazole-3-carboxylic acid Formula: C15H16N4O4 MolecularWeight: 316.31194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)CCN2C(=CC=N2)C(=O)O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)CCN2C(=CC=N2)C(=O)O

InChI

InChI=1S/C15H16N4O4/c1-10(20)17-11-2-4-12(5-3-11)18-14(21)7-9-19-13(15(22)23)6-8-16-19/h2-6,8H,7,9H2,1H3,(H,17,20)(H,18,21)(H,22,23)