4-chloranyl-6-[[(3-phenyl-1,2,4-triazol-4-yl)amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 4-chloranyl-6-[[(3-phenyl-1,2,4-triazol-4-yl)amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 4-chloro-6-[[(3-phenyl-1,2,4-triazol-4-yl)amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 4-chloro-6-[[(3-phenyl-1,2,4-triazol-4-yl)amino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 4-chloro-6-[[(3-phenyl-1,2,4-triazol-4-yl)amino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 4-chloro-6-[[(3-phenyl-1,2,4-triazol-4-yl)amino]methylene]cyclohexa-2,4-dien-1-one Formula: C15H11ClN4O MolecularWeight: 298.72704

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=CN2NC=C3C=C(C=CC3=O)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=CN2NC=C3C=C(C=CC3=O)Cl

InChI

InChI=1S/C15H11ClN4O/c16-13-6-7-14(21)12(8-13)9-18-20-10-17-19-15(20)11-4-2-1-3-5-11/h1-10,18H