N-[2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: N-[2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]pyrazole-4-carboxamide CAS Name: N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]pyrazole-4-carboxamide Traditional Name: 1-benzyl-N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]pyrazole-4-carboxamide Formula: C21H20ClN3O3 MolecularWeight: 397.8548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C=C2Cl)CCNC(=O)C3=CN(N=C3)CC4=CC=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=C(C=C2Cl)CCNC(=O)C3=CN(N=C3)CC4=CC=CC=C4

InChI

InChI=1S/C21H20ClN3O3/c22-18-10-16(11-19-20(18)28-9-8-27-19)6-7-23-21(26)17-12-24-25(14-17)13-15-4-2-1-3-5-15/h1-5,10-12,14H,6-9,13H2,(H,23,26)