N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3-methoxyphenyl)-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3-methoxyphenyl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3-methoxyphenyl)-1-phenyl-pyrazole-4-carboxamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3-methoxyphenyl)-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3-methoxyphenyl)-1-phenylpyrazole-4-carboxamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3-methoxyphenyl)-1-phenyl-pyrazole-4-carboxamide Formula: C26H23N3O4 MolecularWeight: 441.47852

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN(C=C2C(=O)NC3=CC4=C(C=C3)OCCCO4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN(C=C2C(=O)NC3=CC4=C(C=C3)OCCCO4)C5=CC=CC=C5

InChI

InChI=1S/C26H23N3O4/c1-31-21-10-5-7-18(15-21)25-22(17-29(28-25)20-8-3-2-4-9-20)26(30)27-19-11-12-23-24(16-19)33-14-6-13-32-23/h2-5,7-12,15-17H,6,13-14H2,1H3,(H,27,30)