5-chloranyl-3-[[3-[(E)-2-cyanoethenyl]-5-methyl-phenyl]-methoxy-phosphoryl]-4-fluoranyl-1H-indole-2-carboxamide

Systemtic Name: 5-chloranyl-3-[[3-[(E)-2-cyanoethenyl]-5-methyl-phenyl]-methoxy-phosphoryl]-4-fluoranyl-1H-indole-2-carboxamide Openeye Name: 5-chloro-3-[[3-[(E)-2-cyanovinyl]-5-methyl-phenyl]-methoxy-phosphoryl]-4-fluoro-1H-indole-2-carboxamide CAS Name: 5-chloro-3-[[3-[(E)-2-cyanoethenyl]-5-methylphenyl]-methoxyphosphoryl]-4-fluoro-1H-indole-2-carboxamide IUPAC Name: 5-chloro-3-[[3-[(E)-2-cyanoethenyl]-5-methylphenyl]-methoxyphosphoryl]-4-fluoro-1H-indole-2-carboxamide Traditional Name: 5-chloro-3-[[3-[(E)-2-cyanovinyl]-5-methyl-phenyl]-methoxy-phosphoryl]-4-fluoro-1H-indole-2-carboxamide Formula: C20H16ClFN3O3P MolecularWeight: 433.777046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C=CC#N)P(=O)(C2=C(NC3=C2C(=C(C=C3)Cl)F)C(=O)N)OC

Isomeric SMILES

CC1=CC(=CC(=C1)/C=[14CH]/C#N)P(=O)(C2=C(NC3=C2C(=C(C=C3)Cl)F)C(=O)N)OC

InChI

InChI=1S/C20H16ClFN3O3P/c1-11-8-12(4-3-7-23)10-13(9-11)29(27,28-2)19-16-15(25-18(19)20(24)26)6-5-14(21)17(16)22/h3-6,8-10,25H,1-2H3,(H2,24,26)/b4-3+/i3+2