(6E)-6-[2-(3-chloranyl-4-methyl-phenyl)-1H-pyrazol-3-ylidene]-3-methoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[2-(3-chloranyl-4-methyl-phenyl)-1H-pyrazol-3-ylidene]-3-methoxy-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[2-(3-chloro-4-methyl-phenyl)-1H-pyrazol-3-ylidene]-3-methoxy-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[2-(3-chloro-4-methylphenyl)-1H-pyrazol-3-ylidene]-3-methoxy-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[2-(3-chloro-4-methylphenyl)-1H-pyrazol-3-ylidene]-3-methoxycyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[2-(3-chloro-4-methyl-phenyl)-3-pyrazolin-3-ylidene]-3-methoxy-cyclohexa-2,4-dien-1-one Formula: C17H15ClN2O2 MolecularWeight: 314.7662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=C3C=CC(=CC3=O)OC)C=CN2)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2/C(=C/3\C=CC(=CC3=O)OC)/C=CN2)Cl

InChI

InChI=1S/C17H15ClN2O2/c1-11-3-4-12(9-15(11)18)20-16(7-8-19-20)14-6-5-13(22-2)10-17(14)21/h3-10,19H,1-2H3/b16-14+