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

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3,4-dimethoxyphenyl)-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3,4-dimethoxyphenyl)pyrazole-4-carboxamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3,4-dimethoxyphenyl)-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3,4-dimethoxyphenyl)pyrazole-4-carboxamide Traditional Name: 1-benzyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3,4-dimethoxyphenyl)pyrazole-4-carboxamide Formula: C28H27N3O5 MolecularWeight: 485.53108

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C=C2C(=O)NC3=CC4=C(C=C3)OCCCO4)CC5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C=C2C(=O)NC3=CC4=C(C=C3)OCCCO4)CC5=CC=CC=C5)OC

InChI

InChI=1S/C28H27N3O5/c1-33-23-11-9-20(15-25(23)34-2)27-22(18-31(30-27)17-19-7-4-3-5-8-19)28(32)29-21-10-12-24-26(16-21)36-14-6-13-35-24/h3-5,7-12,15-16,18H,6,13-14,17H2,1-2H3,(H,29,32)