3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[[3-(methoxymethyl)phenyl]methyl]-1-methyl-pyrazole-4-carboxamide

Systemtic Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[[3-(methoxymethyl)phenyl]methyl]-1-methyl-pyrazole-4-carboxamide Openeye Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[[3-(methoxymethyl)phenyl]methyl]-1-methyl-pyrazole-4-carboxamide CAS Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[[3-(methoxymethyl)phenyl]methyl]-1-methyl-4-pyrazolecarboxamide IUPAC Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[[3-(methoxymethyl)phenyl]methyl]-1-methylpyrazole-4-carboxamide Traditional Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[3-(methoxymethyl)benzyl]-1-methyl-pyrazole-4-carboxamide Formula: C23H25N3O4 MolecularWeight: 407.4623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC3=C(C=C2)OCCCO3)C(=O)NCC4=CC(=CC=C4)COC

Isomeric SMILES

CN1C=C(C(=N1)C2=CC3=C(C=C2)OCCCO3)C(=O)NCC4=CC(=CC=C4)COC

InChI

InChI=1S/C23H25N3O4/c1-26-14-19(23(27)24-13-16-5-3-6-17(11-16)15-28-2)22(25-26)18-7-8-20-21(12-18)30-10-4-9-29-20/h3,5-8,11-12,14H,4,9-10,13,15H2,1-2H3,(H,24,27)