1-(1,3-benzodioxol-5-yl)-3-[(4-pyridin-4-ylcarbonylphenyl)amino]propan-1-one

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[(4-pyridin-4-ylcarbonylphenyl)amino]propan-1-one Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[4-(pyridine-4-carbonyl)anilino]propan-1-one CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[4-[oxo(pyridin-4-yl)methyl]anilino]-1-propanone IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[4-(pyridine-4-carbonyl)anilino]propan-1-one Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-(4-isonicotinoylanilino)propan-1-one Formula: C22H18N2O4 MolecularWeight: 374.38932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)CCNC3=CC=C(C=C3)C(=O)C4=CC=NC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)CCNC3=CC=C(C=C3)C(=O)C4=CC=NC=C4

InChI

InChI=1S/C22H18N2O4/c25-19(17-3-6-20-21(13-17)28-14-27-20)9-12-24-18-4-1-15(2-5-18)22(26)16-7-10-23-11-8-16/h1-8,10-11,13,24H,9,12,14H2