1-[3-[methyl(phenyl)amino]-3-oxidanylidene-propyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-[3-[methyl(phenyl)amino]-3-oxidanylidene-propyl]pyrazole-4-carboxylic acid Openeye Name: 1-[3-(N-methylanilino)-3-oxo-propyl]pyrazole-4-carboxylic acid CAS Name: 1-[3-(N-methylanilino)-3-oxopropyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-[3-(N-methylanilino)-3-oxopropyl]pyrazole-4-carboxylic acid Traditional Name: 1-[3-keto-3-(N-methylanilino)propyl]pyrazole-4-carboxylic acid Formula: C14H15N3O3 MolecularWeight: 273.2872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N3O3/c1-16(12-5-3-2-4-6-12)13(18)7-8-17-10-11(9-15-17)14(19)20/h2-6,9-10H,7-8H2,1H3,(H,19,20)