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

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-3-carboxamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-3-carboxamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-(3,4-dimethoxyphenyl)-1-phenyl-3-pyrazolecarboxamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-(3,4-dimethoxyphenyl)-1-phenylpyrazole-3-carboxamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-3-carboxamide Formula: C27H25N3O5 MolecularWeight: 471.5045

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CN(N=C2C(=O)NC3=CC4=C(C=C3)OCCCO4)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CN(N=C2C(=O)NC3=CC4=C(C=C3)OCCCO4)C5=CC=CC=C5)OC

InChI

InChI=1S/C27H25N3O5/c1-32-22-11-9-18(15-24(22)33-2)21-17-30(20-7-4-3-5-8-20)29-26(21)27(31)28-19-10-12-23-25(16-19)35-14-6-13-34-23/h3-5,7-12,15-17H,6,13-14H2,1-2H3,(H,28,31)