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

Systemtic Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(3,4-dimethoxyphenyl)-1-methyl-pyrazole-4-carboxamide Openeye Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(3,4-dimethoxyphenyl)-1-methyl-pyrazole-4-carboxamide CAS Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(3,4-dimethoxyphenyl)-1-methyl-4-pyrazolecarboxamide IUPAC Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(3,4-dimethoxyphenyl)-1-methylpyrazole-4-carboxamide Traditional Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(3,4-dimethoxyphenyl)-1-methyl-pyrazole-4-carboxamide Formula: C22H23N3O5 MolecularWeight: 409.43512

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC3=C(C=C2)OCCCO3)C(=O)NC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CN1C=C(C(=N1)C2=CC3=C(C=C2)OCCCO3)C(=O)NC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C22H23N3O5/c1-25-13-16(22(26)23-15-6-8-17(27-2)19(12-15)28-3)21(24-25)14-5-7-18-20(11-14)30-10-4-9-29-18/h5-8,11-13H,4,9-10H2,1-3H3,(H,23,26)