1-[(2S)-1-[(3-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]pyrazole-4-carboxylate

Systemtic Name: 1-[(2S)-1-[(3-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]pyrazole-4-carboxylate Openeye Name: 1-[(1S)-2-(3-methoxyanilino)-1-methyl-2-oxo-ethyl]pyrazole-4-carboxylate CAS Name: 1-[(2S)-1-(3-methoxyanilino)-1-oxopropan-2-yl]-4-pyrazolecarboxylate IUPAC Name: 1-[(2S)-1-(3-methoxyanilino)-1-oxopropan-2-yl]pyrazole-4-carboxylate Traditional Name: 1-[(1S)-2-keto-2-(m-anisidino)-1-methyl-ethyl]pyrazole-4-carboxylate Formula: C14H14N3O4- MolecularWeight: 288.27866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)OC)N2C=C(C=N2)C(=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)NC1=CC(=CC=C1)OC)N2C=C(C=N2)C(=O)[O-]

InChI

InChI=1S/C14H15N3O4/c1-9(17-8-10(7-15-17)14(19)20)13(18)16-11-4-3-5-12(6-11)21-2/h3-9H,1-2H3,(H,16,18)(H,19,20)/p-1/t9-/m0/s1