2-[3-(2-methylprop-2-enoylamino)phenyl]-3-oxidanylidene-pyrazole-1-carboxylic acid

Systemtic Name: 2-[3-(2-methylprop-2-enoylamino)phenyl]-3-oxidanylidene-pyrazole-1-carboxylic acid Openeye Name: 2-[3-(2-methylprop-2-enoylamino)phenyl]-3-oxo-pyrazole-1-carboxylic acid CAS Name: 2-[3-[(2-methyl-1-oxoprop-2-enyl)amino]phenyl]-3-oxo-1-pyrazolecarboxylic acid IUPAC Name: 2-[3-(2-methylprop-2-enoylamino)phenyl]-3-oxopyrazole-1-carboxylic acid Traditional Name: 3-keto-2-(3-methacrylamidophenyl)-3-pyrazoline-1-carboxylic acid Formula: C14H13N3O4 MolecularWeight: 287.27072

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)NC1=CC=CC(=C1)N2C(=O)C=CN2C(=O)O

Isomeric SMILES

CC(=C)C(=O)NC1=CC=CC(=C1)N2C(=O)C=CN2C(=O)O

InChI

InChI=1S/C14H13N3O4/c1-9(2)13(19)15-10-4-3-5-11(8-10)17-12(18)6-7-16(17)14(20)21/h3-8H,1H2,2H3,(H,15,19)(H,20,21)