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

Systemtic Name: 5-cyclopropyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-phenyl-pyrazole-3-carboxamide Openeye Name: 5-cyclopropyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-phenyl-pyrazole-3-carboxamide CAS Name: 5-cyclopropyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-phenyl-3-pyrazolecarboxamide IUPAC Name: 5-cyclopropyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-phenylpyrazole-3-carboxamide Traditional Name: 5-cyclopropyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-phenyl-pyrazole-3-carboxamide Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)C3=CC(=NN3C4=CC=CC=C4)C5CC5)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)C3=CC(=NN3C4=CC=CC=C4)C5CC5)OC1

InChI

InChI=1S/C22H21N3O3/c26-22(23-16-9-10-20-21(13-16)28-12-4-11-27-20)19-14-18(15-7-8-15)24-25(19)17-5-2-1-3-6-17/h1-3,5-6,9-10,13-15H,4,7-8,11-12H2,(H,23,26)