5-[(3-chloranylphenoxy)methyl]-4-[(Z)-pyrrol-2-ylidenemethyl]-1,2-dihydropyrazol-3-one

Systemtic Name: 5-[(3-chloranylphenoxy)methyl]-4-[(Z)-pyrrol-2-ylidenemethyl]-1,2-dihydropyrazol-3-one Openeye Name: 5-[(3-chlorophenoxy)methyl]-4-[(Z)-pyrrol-2-ylidenemethyl]-1,2-dihydropyrazol-3-one CAS Name: 5-[(3-chlorophenoxy)methyl]-4-[(Z)-2-pyrrolylidenemethyl]-1,2-dihydropyrazol-3-one IUPAC Name: 5-[(3-chlorophenoxy)methyl]-4-[(Z)-pyrrol-2-ylidenemethyl]-1,2-dihydropyrazol-3-one Traditional Name: 5-[(3-chlorophenoxy)methyl]-4-[(Z)-pyrrol-2-ylidenemethyl]-3-pyrazolin-3-one Formula: C15H12ClN3O2 MolecularWeight: 301.72768

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)OCC2=C(C(=O)NN2)C=C3C=CC=N3

Isomeric SMILES

C1=CC(=CC(=C1)Cl)OCC2=C(C(=O)NN2)/C=C\3/C=CC=N3

InChI

InChI=1S/C15H12ClN3O2/c16-10-3-1-5-12(7-10)21-9-14-13(15(20)19-18-14)8-11-4-2-6-17-11/h1-8H,9H2,(H2,18,19,20)/b11-8-