3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(1,3-diphenylpyrazol-4-yl)methyl]propanamide

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(1,3-diphenylpyrazol-4-yl)methyl]propanamide Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(1,3-diphenylpyrazol-4-yl)methyl]propanamide CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(1,3-diphenyl-4-pyrazolyl)methyl]propanamide IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(1,3-diphenylpyrazol-4-yl)methyl]propanamide Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(1,3-diphenylpyrazol-4-yl)methyl]propionamide Formula: C27H25N3O3 MolecularWeight: 439.5057

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)CCC(=O)NCC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)CCC(=O)NCC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H25N3O3/c31-26(14-12-20-11-13-24-25(17-20)33-16-15-32-24)28-18-22-19-30(23-9-5-2-6-10-23)29-27(22)21-7-3-1-4-8-21/h1-11,13,17,19H,12,14-16,18H2,(H,28,31)