N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-(4-fluorophenyl)pyrazole-3-carboxamide

Systemtic Name: N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-(4-fluorophenyl)pyrazole-3-carboxamide Openeye Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-(4-fluorophenyl)pyrazole-3-carboxamide CAS Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-(4-fluorophenyl)-3-pyrazolecarboxamide IUPAC Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-(4-fluorophenyl)pyrazole-3-carboxamide Traditional Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-(4-fluorophenyl)pyrazole-3-carboxamide Formula: C19H15ClFN3O3 MolecularWeight: 387.792103

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C(=C2)NC(=O)C3=NN(C=C3)C4=CC=C(C=C4)F)Cl)OC1

Isomeric SMILES

C1COC2=C(C=C(C(=C2)NC(=O)C3=NN(C=C3)C4=CC=C(C=C4)F)Cl)OC1

InChI

InChI=1S/C19H15ClFN3O3/c20-14-10-17-18(27-9-1-8-26-17)11-16(14)22-19(25)15-6-7-24(23-15)13-4-2-12(21)3-5-13/h2-7,10-11H,1,8-9H2,(H,22,25)