N-[2-(1,3-benzodioxol-5-yl)-2-(dimethylamino)ethyl]-5-methyl-3-pyridin-4-yl-1,2-oxazole-4-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)-2-(dimethylamino)ethyl]-5-methyl-3-pyridin-4-yl-1,2-oxazole-4-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)-2-(dimethylamino)ethyl]-5-methyl-3-(4-pyridyl)isoxazole-4-carboxamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)-2-(dimethylamino)ethyl]-5-methyl-3-pyridin-4-yl-4-isoxazolecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)-2-(dimethylamino)ethyl]-5-methyl-3-pyridin-4-yl-1,2-oxazole-4-carboxamide Traditional Name: N-[2-(1,3-benzodioxol-5-yl)-2-(dimethylamino)ethyl]-5-methyl-3-(4-pyridyl)isoxazole-4-carboxamide Formula: C21H22N4O4 MolecularWeight: 394.42378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=NC=C2)C(=O)NCC(C3=CC4=C(C=C3)OCO4)N(C)C

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=NC=C2)C(=O)NCC(C3=CC4=C(C=C3)OCO4)N(C)C

InChI

InChI=1S/C21H22N4O4/c1-13-19(20(24-29-13)14-6-8-22-9-7-14)21(26)23-11-16(25(2)3)15-4-5-17-18(10-15)28-12-27-17/h4-10,16H,11-12H2,1-3H3,(H,23,26)