[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl] 4-chloranyl-1-methyl-pyrazole-3-carboxylate

Systemtic Name: [2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl] 4-chloranyl-1-methyl-pyrazole-3-carboxylate Openeye Name: [2-(1-naphthylamino)-2-oxo-ethyl] 4-chloro-1-methyl-pyrazole-3-carboxylate CAS Name: 4-chloro-1-methyl-3-pyrazolecarboxylic acid [2-(1-naphthalenylamino)-2-oxoethyl] ester IUPAC Name: [2-(naphthalen-1-ylamino)-2-oxoethyl] 4-chloro-1-methylpyrazole-3-carboxylate Traditional Name: 4-chloro-1-methyl-pyrazole-3-carboxylic acid [2-keto-2-(1-naphthylamino)ethyl] ester Formula: C17H14ClN3O3 MolecularWeight: 343.76436

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)OCC(=O)NC2=CC=CC3=CC=CC=C32)Cl

Isomeric SMILES

CN1C=C(C(=N1)C(=O)OCC(=O)NC2=CC=CC3=CC=CC=C32)Cl

InChI

InChI=1S/C17H14ClN3O3/c1-21-9-13(18)16(20-21)17(23)24-10-15(22)19-14-8-4-6-11-5-2-3-7-12(11)14/h2-9H,10H2,1H3,(H,19,22)