4-[(Z)-(4-chloranylpyrrol-2-ylidene)methyl]-5-phenethyl-1,2-dihydropyrazol-3-one

Systemtic Name: 4-[(Z)-(4-chloranylpyrrol-2-ylidene)methyl]-5-phenethyl-1,2-dihydropyrazol-3-one Openeye Name: 4-[(Z)-(4-chloropyrrol-2-ylidene)methyl]-5-phenethyl-1,2-dihydropyrazol-3-one CAS Name: 4-[(Z)-(4-chloro-2-pyrrolylidene)methyl]-5-phenethyl-1,2-dihydropyrazol-3-one IUPAC Name: 4-[(Z)-(4-chloropyrrol-2-ylidene)methyl]-5-phenethyl-1,2-dihydropyrazol-3-one Traditional Name: 4-[(Z)-(4-chloropyrrol-2-ylidene)methyl]-5-phenethyl-3-pyrazolin-3-one Formula: C16H14ClN3O MolecularWeight: 299.75486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=C(C(=O)NN2)C=C3C=C(C=N3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCC2=C(C(=O)NN2)/C=C\3/C=C(C=N3)Cl

InChI

InChI=1S/C16H14ClN3O/c17-12-8-13(18-10-12)9-14-15(19-20-16(14)21)7-6-11-4-2-1-3-5-11/h1-5,8-10H,6-7H2,(H2,19,20,21)/b13-9-